5-butanoyl-6-(4-dimethylaminophenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 5-butanoyl-6-(4-dimethylaminophenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 5-butanoyl-6-(4-dimethylaminophenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 6-(4-dimethylaminophenyl)-5-(1-oxobutyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 5-butanoyl-6-(4-dimethylaminophenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 5-butyryl-6-(4-dimethylaminophenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C25H29N3O2/c1-4-8-23(30)28-21-11-6-5-9-19(21)26-20-10-7-12-22(29)24(20)25(28)17-13-15-18(16-14-17)27(2)3/h5-6,9,11,13-16,25-26H,4,7-8,10,12H2,1-3H3