2-[2-(4-thiophen-2-ylcarbonylphenyl)propanoylamino]ethanesulfonic acid

Systemtic Name: 2-[2-(4-thiophen-2-ylcarbonylphenyl)propanoylamino]ethanesulfonic acid Openeye Name: 2-[2-[4-(thiophene-2-carbonyl)phenyl]propanoylamino]ethanesulfonic acid CAS Name: 2-[[1-oxo-2-[4-[oxo(thiophen-2-yl)methyl]phenyl]propyl]amino]ethanesulfonic acid IUPAC Name: 2-[2-[4-(thiophene-2-carbonyl)phenyl]propanoylamino]ethanesulfonic acid Traditional Name: 2-[2-[4-(2-thenoyl)phenyl]propanoylamino]ethanesulfonic acid Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)C2=CC=CS2)C(=O)NCCS(=O)(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)C2=CC=CS2)C(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C16H17NO5S2/c1-11(16(19)17-8-10-24(20,21)22)12-4-6-13(7-5-12)15(18)14-3-2-9-23-14/h2-7,9,11H,8,10H2,1H3,(H,17,19)(H,20,21,22)