[(3R,4S)-1-[(4-Methoxyphenyl)acetyl]-3-{2-[4-(2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)-1-piperidinyl]ethyl}-4-piperidinyl]acetic acid

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Systematic / IUPAC Name: 2-[(3R,4S)-1-[2-(4-Methoxyphenyl)acetyl]-3-[2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]piperidin-4-yl]acetic acid

ID: Reference9956

Other Names: 4-Piperidineacetic acid, 3-[2-[4-(2,3-dihydro-2-oxo-1H-benzimidazol-1-yl)-1-piperidinyl]ethyl]-1-[2-(4-methoxyphenyl)acetyl]-, (3R,4S)-;
NAT14-336688

Formula: C30H38N4O5

Spectral Data

[(3R,4S)-1-[(4-Methoxyphenyl)acetyl]-3-{2-[4-(2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)-1-piperidinyl]ethyl}-4-piperidinyl]acetic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1677
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 9/24/2020 6:28:04 AM
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Identificators

InChI InChI=1S/C30H38N4O5/c1-39-25-8-6-21(7-9-25)18-28(35)33-17-11-22(19-29(36)37)23(20-33)10-14-32-15-12-24(13-16-32)34-27-5-3-2-4-26(27)31-30(34)38/h2-9,22-24H,10-20H2,1H3,(H,31,38)(H,36,37)/t22-,23-/m0/s1
InChI Key BUSGCSAPYKSHEJ-GOTSBHOMSA-N
Canonical SMILES COC1=CC=C(C=C1)CC(=O)N2CCC(C(C2)CCN3CCC(CC3)N4C5=CC=CC=C5NC4=O)CC(=O)O
CAS
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Other Names 4-Piperidineacetic acid, 3-[2-[4-(2,3-dihydro-2-oxo-1H-benzimidazol-1-yl)-1-piperidinyl]ethyl]-1-[2-(4-methoxyphenyl)acetyl]-, (3R,4S)-;
NAT14-336688

In Other Databases

PubChem 45360516
ChemSpider 22806372