3-[4-(4,5-dimethylthiophen-2-yl)carbonylpiperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(4,5-dimethylthiophen-2-yl)carbonylpiperazin-1-yl]propanoic acid Openeye Name: 3-[4-(4,5-dimethylthiophene-2-carbonyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(4,5-dimethyl-2-thiophenyl)-oxomethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(4,5-dimethylthiophene-2-carbonyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(4,5-dimethylthiophene-2-carbonyl)piperazino]propionic acid Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3S/c1-10-9-12(20-11(10)2)14(19)16-7-5-15(6-8-16)4-3-13(17)18/h9H,3-8H2,1-2H3,(H,17,18)