2-methoxy-5-[[(2-methoxy-4-methylsulfanyl-phenyl)carbonylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[(2-methoxy-4-methylsulfanyl-phenyl)carbonylamino]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[(2-methoxy-4-methylsulfanyl-benzoyl)amino]methyl]benzoic acid CAS Name: 2-methoxy-5-[[[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[(2-methoxy-4-methylsulfanylbenzoyl)amino]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[[2-methoxy-4-(methylthio)benzoyl]amino]methyl]benzoic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=C(C=C2)SC)OC)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=C(C=C2)SC)OC)C(=O)O

InChI

InChI=1S/C18H19NO5S/c1-23-15-7-4-11(8-14(15)18(21)22)10-19-17(20)13-6-5-12(25-3)9-16(13)24-2/h4-9H,10H2,1-3H3,(H,19,20)(H,21,22)