2-[4-(4,5-dimethylthiophen-2-yl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(4,5-dimethylthiophen-2-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(4,5-dimethylthiophene-2-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(4,5-dimethyl-2-thiophenyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(4,5-dimethylthiophene-2-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(4,5-dimethylthiophene-2-carbonyl)piperazino]acetic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3S/c1-9-7-11(19-10(9)2)13(18)15-5-3-14(4-6-15)8-12(16)17/h7H,3-6,8H2,1-2H3,(H,16,17)