4-[1-(4-fluorophenyl)-2-oxidanylidene-1-piperazin-1-yl-ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide

Systemtic Name: 4-[1-(4-fluorophenyl)-2-oxidanylidene-1-piperazin-1-yl-ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide Openeye Name: 4-[1-(4-fluorophenyl)-2-oxo-1-piperazin-1-yl-ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide CAS Name: 4-[1-(4-fluorophenyl)-2-oxo-1-(1-piperazinyl)ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide IUPAC Name: 4-[1-(4-fluorophenyl)-2-oxo-1-piperazin-1-ylethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide Traditional Name: 4-[1-(4-fluorophenyl)-2-keto-1-piperazino-ethyl]-2,3,4,5-tetrahydro-1H-2-benzazepine-8-carboxamide Formula: C23H27FN4O2 MolecularWeight: 410.484483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(C=O)(C2CC3=C(CNC2)C=C(C=C3)C(=O)N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1)C(C=O)(C2CC3=C(CNC2)C=C(C=C3)C(=O)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H27FN4O2/c24-21-5-3-19(4-6-21)23(15-29,28-9-7-26-8-10-28)20-12-16-1-2-17(22(25)30)11-18(16)13-27-14-20/h1-6,11,15,20,26-27H,7-10,12-14H2,(H2,25,30)