4,5-diethoxy-2-[(2-methylsulfanylphenyl)carbonylamino]benzoic acid

Systemtic Name: 4,5-diethoxy-2-[(2-methylsulfanylphenyl)carbonylamino]benzoic acid Openeye Name: 4,5-diethoxy-2-[(2-methylsulfanylbenzoyl)amino]benzoic acid CAS Name: 4,5-diethoxy-2-[[[2-(methylthio)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4,5-diethoxy-2-[(2-methylsulfanylbenzoyl)amino]benzoic acid Traditional Name: 4,5-diethoxy-2-[[2-(methylthio)benzoyl]amino]benzoic acid Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)O)NC(=O)C2=CC=CC=C2SC)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)O)NC(=O)C2=CC=CC=C2SC)OCC

InChI

InChI=1S/C19H21NO5S/c1-4-24-15-10-13(19(22)23)14(11-16(15)25-5-2)20-18(21)12-8-6-7-9-17(12)26-3/h6-11H,4-5H2,1-3H3,(H,20,21)(H,22,23)