6-(3-methoxy-2-oxidanyl-phenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 6-(3-methoxy-2-oxidanyl-phenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 6-(2-hydroxy-3-methoxy-phenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 6-(2-hydroxy-3-methoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 6-(2-hydroxy-3-methoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 6-(2-hydroxy-3-methoxy-phenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3/c1-22(2)11-16-19(17(25)12-22)20(13-7-6-10-18(27-3)21(13)26)24-15-9-5-4-8-14(15)23-16/h4-10,20,23-24,26H,11-12H2,1-3H3