2-[(2-carboxyphenyl)methoxy]-6-(2-sulfanylethyl)benzoic acid

Systemtic Name: 2-[(2-carboxyphenyl)methoxy]-6-(2-sulfanylethyl)benzoic acid Openeye Name: 2-[(2-carboxyphenyl)methoxy]-6-(2-sulfanylethyl)benzoic acid CAS Name: 2-[(2-carboxyphenyl)methoxy]-6-(2-mercaptoethyl)benzoic acid IUPAC Name: 2-[(2-carboxyphenyl)methoxy]-6-(2-sulfanylethyl)benzoic acid Traditional Name: 2-(2-carboxybenzyl)oxy-6-(2-mercaptoethyl)benzoic acid Formula: C17H16O5S MolecularWeight: 332.37094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=CC=CC(=C2C(=O)O)CCS)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)COC2=CC=CC(=C2C(=O)O)CCS)C(=O)O

InChI

InChI=1S/C17H16O5S/c18-16(19)13-6-2-1-4-12(13)10-22-14-7-3-5-11(8-9-23)15(14)17(20)21/h1-7,23H,8-10H2,(H,18,19)(H,20,21)