2-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonylethanoic acid

Systemtic Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonylethanoic acid Openeye Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonylacetic acid CAS Name: 2-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]acetic acid IUPAC Name: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonylacetic acid Traditional Name: 2-[4-(2,3-dimethylphenyl)piperazino]sulfonylacetic acid Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4S/c1-11-4-3-5-13(12(11)2)15-6-8-16(9-7-15)21(19,20)10-14(17)18/h3-5H,6-10H2,1-2H3,(H,17,18)