2-(2-aminocarbonyl-5-ethoxy-phenyl)sulfanylethanoic acid

Systemtic Name: 2-(2-aminocarbonyl-5-ethoxy-phenyl)sulfanylethanoic acid Openeye Name: 2-(2-carbamoyl-5-ethoxy-phenyl)sulfanylacetic acid CAS Name: 2-[(2-carbamoyl-5-ethoxyphenyl)thio]acetic acid IUPAC Name: 2-(2-carbamoyl-5-ethoxyphenyl)sulfanylacetic acid Traditional Name: 2-[(2-carbamoyl-5-ethoxy-phenyl)thio]acetic acid Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)N)SCC(=O)O

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)N)SCC(=O)O

InChI

InChI=1S/C11H13NO4S/c1-2-16-7-3-4-8(11(12)15)9(5-7)17-6-10(13)14/h3-5H,2,6H2,1H3,(H2,12,15)(H,13,14)