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

Systemtic Name: 4-[[2-methoxy-4-[(2-sulfanylphenyl)iminomethyl]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-methoxy-4-[(2-sulfanylphenyl)iminomethyl]phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(2-mercaptophenyl)iminomethyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-methoxy-4-[(2-sulfanylphenyl)iminomethyl]phenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[(2-mercaptophenyl)iminomethyl]-2-methoxy-phenoxy]methyl]benzoic acid Formula: C22H19NO4S MolecularWeight: 393.45556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NC2=CC=CC=C2S)OCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=NC2=CC=CC=C2S)OCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H19NO4S/c1-26-20-12-16(13-23-18-4-2-3-5-21(18)28)8-11-19(20)27-14-15-6-9-17(10-7-15)22(24)25/h2-13,28H,14H2,1H3,(H,24,25)