2-[1-[1-oxidanylidene-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[1-oxidanylidene-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[1-methyl-2-oxo-2-[4-(4-pyridyl)piperazin-1-yl]ethyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[1-oxo-1-(4-pyridin-4-yl-1-piperazinyl)propan-2-yl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[1-oxo-1-(4-pyridin-4-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[2-keto-1-methyl-2-[4-(4-pyridyl)piperazino]ethyl]-4-piperidyl]acetic acid Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=NC=C2)N3CCC(CC3)CC(=O)O

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=NC=C2)N3CCC(CC3)CC(=O)O

InChI

InChI=1S/C19H28N4O3/c1-15(21-8-4-16(5-9-21)14-18(24)25)19(26)23-12-10-22(11-13-23)17-2-6-20-7-3-17/h2-3,6-7,15-16H,4-5,8-14H2,1H3,(H,24,25)