3-[1-(carboxymethyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(carboxymethyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(carboxymethyl)-5-(2-thienyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(carboxymethyl)-5-thiophen-2-yl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(carboxymethyl)-5-thiophen-2-ylpyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(carboxymethyl)-5-(2-thienyl)pyrrol-2-yl]propionic acid Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC=C(N2CC(=O)O)CCC(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=CC=C(N2CC(=O)O)CCC(=O)O

InChI

InChI=1S/C13H13NO4S/c15-12(16)6-4-9-3-5-10(11-2-1-7-19-11)14(9)8-13(17)18/h1-3,5,7H,4,6,8H2,(H,15,16)(H,17,18)