3,9,9-trimethyl-6-phenyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 3,9,9-trimethyl-6-phenyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 3,9,9-trimethyl-6-phenyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 3,9,9-trimethyl-6-phenyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 3,9,9-trimethyl-6-phenyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 3,9,9-trimethyl-6-phenyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Formula: C22H24N2O MolecularWeight: 332.43876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC3=CC(CC(=O)C3C(N2)C4=CC=CC=C4)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC3=CC(CC(=O)C3C(N2)C4=CC=CC=C4)(C)C

InChI

InChI=1S/C22H24N2O/c1-14-9-10-16-17(11-14)24-21(15-7-5-4-6-8-15)20-18(23-16)12-22(2,3)13-19(20)25/h4-12,20-21,23-24H,13H2,1-3H3