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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)N2CCN(CC2)CCC(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(=O)N2CCN(CC2)CCC(=O)O

InChI

InChI=1S/C14H20N2O3S/c1-2-11-3-4-12(20-11)14(19)16-9-7-15(8-10-16)6-5-13(17)18/h3-4H,2,5-10H2,1H3,(H,17,18)