5-ethanoyl-9,9-dimethyl-6-(3,4,5-trimethoxyphenyl)-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 5-ethanoyl-9,9-dimethyl-6-(3,4,5-trimethoxyphenyl)-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Openeye Name: 5-acetyl-9,9-dimethyl-6-(3,4,5-trimethoxyphenyl)-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one CAS Name: 5-acetyl-9,9-dimethyl-6-(3,4,5-trimethoxyphenyl)-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one IUPAC Name: 5-acetyl-9,9-dimethyl-6-(3,4,5-trimethoxyphenyl)-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Traditional Name: 5-acetyl-9,9-dimethyl-6-(3,4,5-trimethoxyphenyl)-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C2C(=O)CC(C=C2NC3=CC=CC=C31)(C)C)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC(=O)N1C(C2C(=O)CC(C=C2NC3=CC=CC=C31)(C)C)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C26H30N2O5/c1-15(29)28-19-10-8-7-9-17(19)27-18-13-26(2,3)14-20(30)23(18)24(28)16-11-21(31-4)25(33-6)22(12-16)32-5/h7-13,23-24,27H,14H2,1-6H3