7-chloranyl-N-(2,6-dimethylphenyl)-2,5-bis(oxidanylidene)-4-propyl-1,3-dihydro-1,4-benzodiazepine-3-carboxamide

Systemtic Name: 7-chloranyl-N-(2,6-dimethylphenyl)-2,5-bis(oxidanylidene)-4-propyl-1,3-dihydro-1,4-benzodiazepine-3-carboxamide Openeye Name: 7-chloro-N-(2,6-dimethylphenyl)-2,5-dioxo-4-propyl-1,3-dihydro-1,4-benzodiazepine-3-carboxamide CAS Name: 7-chloro-N-(2,6-dimethylphenyl)-2,5-dioxo-4-propyl-1,3-dihydro-1,4-benzodiazepine-3-carboxamide IUPAC Name: 7-chloro-N-(2,6-dimethylphenyl)-2,5-dioxo-4-propyl-1,3-dihydro-1,4-benzodiazepine-3-carboxamide Traditional Name: 7-chloro-N-(2,6-dimethylphenyl)-2,5-diketo-4-propyl-1,3-dihydro-1,4-benzodiazepine-3-carboxamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(=O)NC2=C(C1=O)C=C(C=C2)Cl)C(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCCN1C(C(=O)NC2=C(C1=O)C=C(C=C2)Cl)C(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C21H22ClN3O3/c1-4-10-25-18(20(27)24-17-12(2)6-5-7-13(17)3)19(26)23-16-9-8-14(22)11-15(16)21(25)28/h5-9,11,18H,4,10H2,1-3H3,(H,23,26)(H,24,27)