2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-(2,5-dimethylphenyl)-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-(2,5-dimethylphenyl)piperazino]-2-keto-acetic acid Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C(=O)O

InChI

InChI=1S/C14H18N2O3/c1-10-3-4-11(2)12(9-10)15-5-7-16(8-6-15)13(17)14(18)19/h3-4,9H,5-8H2,1-2H3,(H,18,19)