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

Systemtic Name: 7-chloranyl-1-methyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3-[(2-phenethylphenyl)methyl]-3,4-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-methyl-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3-[(2-phenethylphenyl)methyl]-3,4-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-methyl-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-3-[(2-phenethylphenyl)methyl]-3,4-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-methyl-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3-[(2-phenethylphenyl)methyl]-3,4-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-1-methyl-3-(2-phenethylbenzyl)-3,4-dihydro-1,4-benzodiazepin-2-one Formula: C31H27ClN2O2 MolecularWeight: 495.01128

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)C(=C3C=CC(=O)C=C3)NC(C1=O)CC4=CC=CC=C4CCC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)C(=C3C=CC(=O)C=C3)NC(C1=O)CC4=CC=CC=C4CCC5=CC=CC=C5

InChI

InChI=1S/C31H27ClN2O2/c1-34-29-18-15-25(32)20-27(29)30(23-13-16-26(35)17-14-23)33-28(31(34)36)19-24-10-6-5-9-22(24)12-11-21-7-3-2-4-8-21/h2-10,13-18,20,28,33H,11-12,19H2,1H3