(1R,9R)-5-[(E)-2-(4-Chlorophenyl)vinyl]-N-(2-methoxyphenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide

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Systematic / IUPAC Name: (1R,9R)-5-[(E)-2-(4-Chlorophenyl)ethenyl]-N-(2-methoxyphenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide

ID: Reference12235

Other Names: NAT11-285456

Formula: C27H26ClN3O3

Spectral Data

(1R,9R)-5-[(E)-2-(4-Chlorophenyl)vinyl]-N-(2-methoxyphenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide 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 3003
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 2/9/2023 9:06:26 PM
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Identificators

InChI InChI=1S/C27H26ClN3O3/c1-34-25-5-3-2-4-23(25)29-27(33)30-15-19-14-21(17-30)24-13-10-20(26(32)31(24)16-19)9-6-18-7-11-22(28)12-8-18/h2-13,19,21H,14-17H2,1H3,(H,29,33)/b9-6+/t19-,21+/m0/s1
InChI Key POPXNFCOJQQOAA-NTPJFSOPSA-N
Canonical SMILES COC1=CC=CC=C1NC(=O)N2CC3CC(C2)C4=CC=C(C(=O)N4C3)C=CC5=CC=C(C=C5)Cl
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Other Names NAT11-285456

In Other Databases

ChemSpider 5977674
PubChem 7663767