7-chloranyl-3-[(2-ethylphenyl)methyl]-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-3-[(2-ethylphenyl)methyl]-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-3-[(2-ethylphenyl)methyl]-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-3-[(2-ethylphenyl)methyl]-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-3-[(2-ethylphenyl)methyl]-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-3-(2-ethylbenzyl)-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one Formula: C24H21ClN2O2 MolecularWeight: 404.88874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1CC2C(=O)NC3=C(C=C(C=C3)Cl)C(=C4C=CC(=O)C=C4)N2

Isomeric SMILES

CCC1=CC=CC=C1CC2C(=O)NC3=C(C=C(C=C3)Cl)C(=C4C=CC(=O)C=C4)N2

InChI

InChI=1S/C24H21ClN2O2/c1-2-15-5-3-4-6-17(15)13-22-24(29)27-21-12-9-18(25)14-20(21)23(26-22)16-7-10-19(28)11-8-16/h3-12,14,22,26H,2,13H2,1H3,(H,27,29)