4-[[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoic acid

Systemtic Name: 4-[[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoic acid Openeye Name: 4-[[2-(2-ethoxyanilino)-2-oxo-ethyl]sulfanylmethyl]benzoic acid CAS Name: 4-[[[2-(2-ethoxyanilino)-2-oxoethyl]thio]methyl]benzoic acid IUPAC Name: 4-[[2-(2-ethoxyanilino)-2-oxoethyl]sulfanylmethyl]benzoic acid Traditional Name: 4-[[[2-keto-2-(o-phenetidino)ethyl]thio]methyl]benzoic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CSCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CSCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H19NO4S/c1-2-23-16-6-4-3-5-15(16)19-17(20)12-24-11-13-7-9-14(10-8-13)18(21)22/h3-10H,2,11-12H2,1H3,(H,19,20)(H,21,22)