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

Systemtic Name: 5-cyclopropylcarbonyl-6-(4-dimethylaminophenyl)-9,9-dimethyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Openeye Name: 5-(cyclopropanecarbonyl)-6-(4-dimethylaminophenyl)-9,9-dimethyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one CAS Name: 5-[cyclopropyl(oxo)methyl]-6-(4-dimethylaminophenyl)-9,9-dimethyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one IUPAC Name: 5-(cyclopropanecarbonyl)-6-(4-dimethylaminophenyl)-9,9-dimethyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Traditional Name: 5-(cyclopropanecarbonyl)-6-(4-dimethylaminophenyl)-9,9-dimethyl-6,6a,8,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2C(N(C3=CC=CC=C3NC2=C1)C(=O)C4CC4)C5=CC=C(C=C5)N(C)C)C

Isomeric SMILES

CC1(CC(=O)C2C(N(C3=CC=CC=C3NC2=C1)C(=O)C4CC4)C5=CC=C(C=C5)N(C)C)C

InChI

InChI=1S/C27H31N3O2/c1-27(2)15-21-24(23(31)16-27)25(17-11-13-19(14-12-17)29(3)4)30(26(32)18-9-10-18)22-8-6-5-7-20(22)28-21/h5-8,11-15,18,24-25,28H,9-10,16H2,1-4H3