5-[4-(2-fluorophenyl)piperazin-1-yl]-3-(methylamino)-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-(2-fluorophenyl)piperazin-1-yl]-3-(methylamino)-4-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(2-fluorophenyl)piperazin-1-yl]-3-(methylamino)-4-oxo-pentanoic acid CAS Name: 5-[4-(2-fluorophenyl)-1-piperazinyl]-3-(methylamino)-4-oxopentanoic acid IUPAC Name: 5-[4-(2-fluorophenyl)piperazin-1-yl]-3-(methylamino)-4-oxopentanoic acid Traditional Name: 5-[4-(2-fluorophenyl)piperazino]-4-keto-3-(methylamino)valeric acid Formula: C16H22FN3O3 MolecularWeight: 323.362583

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC(=O)O)C(=O)CN1CCN(CC1)C2=CC=CC=C2F

Isomeric SMILES

CNC(CC(=O)O)C(=O)CN1CCN(CC1)C2=CC=CC=C2F

InChI

InChI=1S/C16H22FN3O3/c1-18-13(10-16(22)23)15(21)11-19-6-8-20(9-7-19)14-5-3-2-4-12(14)17/h2-5,13,18H,6-11H2,1H3,(H,22,23)