2-[2-methoxy-4-(phenethylcarbamothioyl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-methoxy-4-(phenethylcarbamothioyl)phenoxy]ethanoic acid Openeye Name: 2-[2-methoxy-4-(phenethylcarbamothioyl)phenoxy]acetic acid CAS Name: 2-[2-methoxy-4-[(phenethylamino)-sulfanylidenemethyl]phenoxy]acetic acid IUPAC Name: 2-[2-methoxy-4-(phenethylcarbamothioyl)phenoxy]acetic acid Traditional Name: 2-[2-methoxy-4-(phenethylthiocarbamoyl)phenoxy]acetic acid Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=S)NCCC2=CC=CC=C2)OCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=S)NCCC2=CC=CC=C2)OCC(=O)O

InChI

InChI=1S/C18H19NO4S/c1-22-16-11-14(7-8-15(16)23-12-17(20)21)18(24)19-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,19,24)(H,20,21)