9,9-dimethyl-6-phenyl-5-(phenylcarbonyl)-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 9,9-dimethyl-6-phenyl-5-(phenylcarbonyl)-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Openeye Name: 5-benzoyl-9,9-dimethyl-6-phenyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one CAS Name: 5-benzoyl-9,9-dimethyl-6-phenyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one IUPAC Name: 5-benzoyl-9,9-dimethyl-6-phenyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Traditional Name: 5-benzoyl-9,9-dimethyl-6-phenyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Formula: C28H26N2O2 MolecularWeight: 422.51824

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2C(N(C3=CC=CC=C3NC2=C1)C(=O)C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1(CC(=O)C2C(N(C3=CC=CC=C3NC2=C1)C(=O)C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C28H26N2O2/c1-28(2)17-22-25(24(31)18-28)26(19-11-5-3-6-12-19)30(23-16-10-9-15-21(23)29-22)27(32)20-13-7-4-8-14-20/h3-17,25-26,29H,18H2,1-2H3