N-(3-fluorophenyl)-2-[4-[4-(4-methylphenyl)-4-oxidanylidene-butanoyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-[4-(4-methylphenyl)-4-oxidanylidene-butanoyl]piperazin-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-[4-oxo-4-(p-tolyl)butanoyl]piperazin-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[4-(4-methylphenyl)-1,4-dioxobutyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-[4-(4-methylphenyl)-4-oxobutanoyl]piperazin-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-[4-keto-4-(p-tolyl)butanoyl]piperazino]acetamide Formula: C23H26FN3O3 MolecularWeight: 411.469243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C23H26FN3O3/c1-17-5-7-18(8-6-17)21(28)9-10-23(30)27-13-11-26(12-14-27)16-22(29)25-20-4-2-3-19(24)15-20/h2-8,15H,9-14,16H2,1H3,(H,25,29)