6-(4-dimethylaminophenyl)-9-phenyl-5-propanoyl-6a,8,9,10-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 6-(4-dimethylaminophenyl)-9-phenyl-5-propanoyl-6a,8,9,10-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 6-(4-dimethylaminophenyl)-9-phenyl-5-propanoyl-6a,8,9,10-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 6-(4-dimethylaminophenyl)-5-(1-oxopropyl)-9-phenyl-6a,8,9,10-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 6-(4-dimethylaminophenyl)-9-phenyl-5-propanoyl-6a,8,9,10-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 6-(4-dimethylaminophenyl)-9-phenyl-5-propionyl-6a,8,9,10-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Formula: C30H31N3O2 MolecularWeight: 465.58604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(C2C(=NC3=CC=CC=C31)CC(CC2=O)C4=CC=CC=C4)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CCC(=O)N1C(C2C(=NC3=CC=CC=C31)CC(CC2=O)C4=CC=CC=C4)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C30H31N3O2/c1-4-28(35)33-26-13-9-8-12-24(26)31-25-18-22(20-10-6-5-7-11-20)19-27(34)29(25)30(33)21-14-16-23(17-15-21)32(2)3/h5-17,22,29-30H,4,18-19H2,1-3H3