7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3-(phenylmethyl)-3,4-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3-(phenylmethyl)-3,4-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 3-benzyl-7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-3-(phenylmethyl)-3,4-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 3-benzyl-7-chloro-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 3-benzyl-7-chloro-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1H-1,4-benzodiazepin-2-one Formula: C22H17ClN2O2 MolecularWeight: 376.83558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(=O)NC3=C(C=C(C=C3)Cl)C(=C4C=CC(=O)C=C4)N2

Isomeric SMILES

C1=CC=C(C=C1)CC2C(=O)NC3=C(C=C(C=C3)Cl)C(=C4C=CC(=O)C=C4)N2

InChI

InChI=1S/C22H17ClN2O2/c23-16-8-11-19-18(13-16)21(15-6-9-17(26)10-7-15)24-20(22(27)25-19)12-14-4-2-1-3-5-14/h1-11,13,20,24H,12H2,(H,25,27)