4-[[2-methoxy-4-[(2-methylsulfanylphenyl)iminomethyl]phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-methoxy-4-[(2-methylsulfanylphenyl)iminomethyl]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-methoxy-4-[(2-methylsulfanylphenyl)iminomethyl]phenoxy]methyl]benzoic acid CAS Name: 4-[[2-methoxy-4-[[2-(methylthio)phenyl]iminomethyl]phenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-methoxy-4-[(2-methylsulfanylphenyl)iminomethyl]phenoxy]methyl]benzoic acid Traditional Name: 4-[[2-methoxy-4-[[2-(methylthio)phenyl]iminomethyl]phenoxy]methyl]benzoic acid Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NC2=CC=CC=C2SC)OCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=NC2=CC=CC=C2SC)OCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H21NO4S/c1-27-21-13-17(14-24-19-5-3-4-6-22(19)29-2)9-12-20(21)28-15-16-7-10-18(11-8-16)23(25)26/h3-14H,15H2,1-2H3,(H,25,26)