(3E)-3-hydroxyimino-1-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)-5-phenyl-1,4-benzodiazepin-2-one

Systemtic Name: (3E)-3-hydroxyimino-1-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)-5-phenyl-1,4-benzodiazepin-2-one Openeye Name: (3E)-3-hydroxyimino-1-[2-(2-naphthyl)-2-oxo-ethyl]-5-phenyl-1,4-benzodiazepin-2-one CAS Name: (3E)-3-hydroxyimino-1-[2-(2-naphthalenyl)-2-oxoethyl]-5-phenyl-1,4-benzodiazepin-2-one IUPAC Name: (3E)-3-hydroxyimino-1-(2-naphthalen-2-yl-2-oxoethyl)-5-phenyl-1,4-benzodiazepin-2-one Traditional Name: (3E)-3-hydroximino-1-[2-keto-2-(2-naphthyl)ethyl]-5-phenyl-1,4-benzodiazepin-2-one Formula: C27H19N3O3 MolecularWeight: 433.45806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NO)C(=O)N(C3=CC=CC=C32)CC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=N/C(=N/O)/C(=O)N(C3=CC=CC=C32)CC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H19N3O3/c31-24(21-15-14-18-8-4-5-11-20(18)16-21)17-30-23-13-7-6-12-22(23)25(19-9-2-1-3-10-19)28-26(29-33)27(30)32/h1-16,33H,17H2/b29-26+