4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(5-chloro-2-methyl-phenyl)piperazino]-4-keto-butyric acid Formula: C15H19ClN2O3 MolecularWeight: 310.77596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCC(=O)O

InChI

InChI=1S/C15H19ClN2O3/c1-11-2-3-12(16)10-13(11)17-6-8-18(9-7-17)14(19)4-5-15(20)21/h2-3,10H,4-9H2,1H3,(H,20,21)