1-[2-(2,4-Dimethoxyphenyl)-6,12-dioxo-5,6,6a,7,8,9,10,12-octahydropyrido[2,1-c][1,4]benzodiazepin-8-yl]-1H-1,2,3-triazole-4,5-dicarboxamide

Systematic / IUPAC Name: 1-[2-(2,4-Dimethoxyphenyl)-6,12-dioxo-5,6a,7,8,9,10-hexahydropyrido[2,1-c][1,4]benzodiazepin-8-yl]triazole-4,5-dicarboxamide

ID: Reference9020

Other Names: 1H-1,2,3-Triazole-4,5-dicarboxamide, 1-[2-(2,4-dimethoxyphenyl)-5,6,6a,7,8,9,10,12-octahydro-6,12-dioxopyrido[2,1-c][1,4]benzodiazepin-8-yl]-;
NAT7-229322

Formula: C25H25N7O6

Spectral Data

1-[2-(2,4-Dimethoxyphenyl)-6,12-dioxo-5,6,6a,7,8,9,10,12-octahydropyrido[2,1-c][1,4]benzodiazepin-8-yl]-1H-1,2,3-triazole-4,5-dicarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 553
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/17/2019 8:18:36 AM
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Identificators

InChI InChI=1S/C25H25N7O6/c1-37-14-4-5-15(19(11-14)38-2)12-3-6-17-16(9-12)25(36)31-8-7-13(10-18(31)24(35)28-17)32-21(23(27)34)20(22(26)33)29-30-32/h3-6,9,11,13,18H,7-8,10H2,1-2H3,(H2,26,33)(H2,27,34)(H,28,35)
InChI Key CNHWSUVVFDDOFF-UHFFFAOYSA-N
Canonical SMILES COC1=CC(=C(C=C1)C2=CC3=C(C=C2)NC(=O)C4CC(CCN4C3=O)N5C(=C(N=N5)C(=O)N)C(=O)N)OC
CAS
Splash
Other Names 1H-1,2,3-Triazole-4,5-dicarboxamide, 1-[2-(2,4-dimethoxyphenyl)-5,6,6a,7,8,9,10,12-octahydro-6,12-dioxopyrido[2,1-c][1,4]benzodiazepin-8-yl]-;
NAT7-229322

In Other Databases

PubChem 3689195
ChemSpider 2921460