2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-2-keto-acetic acid Formula: C14H18N2O7S MolecularWeight: 358.36692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(=O)O)OC

InChI

InChI=1S/C14H18N2O7S/c1-22-11-4-3-10(9-12(11)23-2)24(20,21)16-7-5-15(6-8-16)13(17)14(18)19/h3-4,9H,5-8H2,1-2H3,(H,18,19)