4-(4-chlorophenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-chlorophenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chlorophenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-(4-chlorophenyl)-2-[4-(2-hydroxyethyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-(4-chlorophenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-(4-chlorophenyl)-2-[4-(2-hydroxyethyl)piperazino]-4-keto-butyric acid Formula: C16H21ClN2O4 MolecularWeight: 340.80194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1CN(CCN1CCO)C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H21ClN2O4/c17-13-3-1-12(2-4-13)15(21)11-14(16(22)23)19-7-5-18(6-8-19)9-10-20/h1-4,14,20H,5-11H2,(H,22,23)