1-methyl-3-(naphthalen-2-ylmethyl)-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 1-methyl-3-(naphthalen-2-ylmethyl)-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-2-one Openeye Name: 1-methyl-3-(2-naphthylmethyl)-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-2-one CAS Name: 1-methyl-3-(2-naphthalenylmethyl)-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-3,4-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 1-methyl-3-(naphthalen-2-ylmethyl)-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-2-one Traditional Name: 5-(4-ketocyclohexa-2,5-dien-1-ylidene)-1-methyl-3-(2-naphthylmethyl)-3,4-dihydro-1,4-benzodiazepin-2-one Formula: C27H22N2O2 MolecularWeight: 406.47578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C3C=CC(=O)C=C3)NC(C1=O)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=C3C=CC(=O)C=C3)NC(C1=O)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H22N2O2/c1-29-25-9-5-4-8-23(25)26(20-12-14-22(30)15-13-20)28-24(27(29)31)17-18-10-11-19-6-2-3-7-21(19)16-18/h2-16,24,28H,17H2,1H3