(6R,6aS)-6-(2,4-dichlorophenyl)-2,3,9,9-tetramethyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: (6R,6aS)-6-(2,4-dichlorophenyl)-2,3,9,9-tetramethyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: (6R,6aS)-6-(2,4-dichlorophenyl)-2,3,9,9-tetramethyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one CAS Name: (6R,6aS)-6-(2,4-dichlorophenyl)-2,3,9,9-tetramethyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: (6R,6aS)-6-(2,4-dichlorophenyl)-2,3,9,9-tetramethyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: (6R,6aS)-6-(2,4-dichlorophenyl)-2,3,9,9-tetramethyl-6,6a,8,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Formula: C23H24Cl2N2O MolecularWeight: 415.35546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)NC3=CC(CC(=O)C3C(N2)C4=C(C=C(C=C4)Cl)Cl)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C)NC3=CC(CC(=O)[C@H]3[C@@H](N2)C4=C(C=C(C=C4)Cl)Cl)(C)C

InChI

InChI=1S/C23H24Cl2N2O/c1-12-7-17-18(8-13(12)2)27-22(15-6-5-14(24)9-16(15)25)21-19(26-17)10-23(3,4)11-20(21)28/h5-10,21-22,26-27H,11H2,1-4H3/t21-,22-/m0/s1