3-(2-oxidanylidene-8-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl)benzenecarbonitrile

Systemtic Name: 3-(2-oxidanylidene-8-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl)benzenecarbonitrile Openeye Name: 3-(2-oxo-8-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl)benzonitrile CAS Name: 3-(2-oxo-8-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl)benzonitrile IUPAC Name: 3-(2-oxo-8-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl)benzonitrile Traditional Name: 3-(2-keto-8-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl)benzonitrile Formula: C22H15N3O MolecularWeight: 337.374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)C3=CC=CC=C3)NC1=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)C3=CC=CC=C3)NC1=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H15N3O/c23-14-15-5-4-8-18(11-15)20-13-22(26)25-21-12-17(9-10-19(21)24-20)16-6-2-1-3-7-16/h1-12H,13H2,(H,25,26)