5-[2-(4-acetamidophenyl)sulfanylpropanoylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-(4-acetamidophenyl)sulfanylpropanoylamino]-2-oxidanyl-benzoic acid Openeye Name: 5-[2-(4-acetamidophenyl)sulfanylpropanoylamino]-2-hydroxy-benzoic acid CAS Name: 5-[[2-[(4-acetamidophenyl)thio]-1-oxopropyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-[2-(4-acetamidophenyl)sulfanylpropanoylamino]-2-hydroxybenzoic acid Traditional Name: 5-[2-[(4-acetamidophenyl)thio]propanoylamino]-2-hydroxy-benzoic acid Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)O)C(=O)O)SC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)O)C(=O)O)SC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C18H18N2O5S/c1-10(26-14-6-3-12(4-7-14)19-11(2)21)17(23)20-13-5-8-16(22)15(9-13)18(24)25/h3-10,22H,1-2H3,(H,19,21)(H,20,23)(H,24,25)