3-[4-(3-methylthiophen-2-yl)carbonylpiperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(3-methylthiophen-2-yl)carbonylpiperazin-1-yl]propanoic acid Openeye Name: 3-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(3-methyl-2-thiophenyl)-oxomethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(3-methylthiophene-2-carbonyl)piperazino]propionic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3S/c1-10-3-9-19-12(10)13(18)15-7-5-14(6-8-15)4-2-11(16)17/h3,9H,2,4-8H2,1H3,(H,16,17)