6-(4-methoxyphenyl)-9,9-dimethyl-6,6a,8,10,10a,11-hexahydro-5H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 6-(4-methoxyphenyl)-9,9-dimethyl-6,6a,8,10,10a,11-hexahydro-5H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 6-(4-methoxyphenyl)-9,9-dimethyl-6,6a,8,10,10a,11-hexahydro-5H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 6-(4-methoxyphenyl)-9,9-dimethyl-6,6a,8,10,10a,11-hexahydro-5H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 6-(4-methoxyphenyl)-9,9-dimethyl-6,6a,8,10,10a,11-hexahydro-5H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 6-(4-methoxyphenyl)-9,9-dimethyl-6,6a,8,10,10a,11-hexahydro-5H-benzo[b][1,4]benzodiazepin-7-one Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2C(C(NC3=CC=CC=C3N2)C4=CC=C(C=C4)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2C(C(NC3=CC=CC=C3N2)C4=CC=C(C=C4)OC)C(=O)C1)C

InChI

InChI=1S/C22H26N2O2/c1-22(2)12-18-20(19(25)13-22)21(14-8-10-15(26-3)11-9-14)24-17-7-5-4-6-16(17)23-18/h4-11,18,20-21,23-24H,12-13H2,1-3H3