9,9-dimethyl-6-phenylazanyl-10,11-dihydro-8H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 9,9-dimethyl-6-phenylazanyl-10,11-dihydro-8H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 6-anilino-9,9-dimethyl-10,11-dihydro-8H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 6-anilino-9,9-dimethyl-10,11-dihydro-8H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 6-anilino-9,9-dimethyl-10,11-dihydro-8H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 6-anilino-9,9-dimethyl-10,11-dihydro-8H-benzo[b][1,4]benzodiazepin-7-one Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=NC3=CC=CC=C3N2)NC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=NC3=CC=CC=C3N2)NC4=CC=CC=C4)C

InChI

InChI=1S/C21H21N3O/c1-21(2)12-17-19(18(25)13-21)20(22-14-8-4-3-5-9-14)24-16-11-7-6-10-15(16)23-17/h3-11,23H,12-13H2,1-2H3,(H,22,24)