4-[1-(4-fluorophenyl)-2-oxidanylidene-1-piperazin-1-yl-ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxamide

Systemtic Name: 4-[1-(4-fluorophenyl)-2-oxidanylidene-1-piperazin-1-yl-ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxamide Openeye Name: 4-[1-(4-fluorophenyl)-2-oxo-1-piperazin-1-yl-ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxamide CAS Name: 4-[1-(4-fluorophenyl)-2-oxo-1-(1-piperazinyl)ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxamide IUPAC Name: 4-[1-(4-fluorophenyl)-2-oxo-1-piperazin-1-ylethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxamide Traditional Name: 4-[1-(4-fluorophenyl)-2-keto-1-piperazino-ethyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxamide Formula: C23H27FN4O2 MolecularWeight: 410.484483

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(CC2=C1C=CC(=C2)C(=O)N)C(C=O)(C3=CC=C(C=C3)F)N4CCNCC4

Isomeric SMILES

C1CNC(CC2=C1C=CC(=C2)C(=O)N)C(C=O)(C3=CC=C(C=C3)F)N4CCNCC4

InChI

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