4-[4-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-yl]-2-oxo-ethoxy]phenyl]benzonitrile CAS Name: 4-[4-[2-[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-2-oxoethoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[2-[4-(4-acetyl-2-fluorophenyl)piperazin-1-yl]-2-oxoethoxy]phenyl]benzonitrile Traditional Name: 4-[4-[2-[4-(4-acetyl-2-fluoro-phenyl)piperazino]-2-keto-ethoxy]phenyl]benzonitrile Formula: C27H24FN3O3 MolecularWeight: 457.496163

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)F

InChI

InChI=1S/C27H24FN3O3/c1-19(32)23-8-11-26(25(28)16-23)30-12-14-31(15-13-30)27(33)18-34-24-9-6-22(7-10-24)21-4-2-20(17-29)3-5-21/h2-11,16H,12-15,18H2,1H3