4-[(2-chloranyl-7-methoxy-quinolin-3-yl)methylsulfanylmethyl]benzoic acid

Systemtic Name: 4-[(2-chloranyl-7-methoxy-quinolin-3-yl)methylsulfanylmethyl]benzoic acid Openeye Name: 4-[(2-chloro-7-methoxy-3-quinolyl)methylsulfanylmethyl]benzoic acid CAS Name: 4-[[(2-chloro-7-methoxy-3-quinolinyl)methylthio]methyl]benzoic acid IUPAC Name: 4-[(2-chloro-7-methoxyquinolin-3-yl)methylsulfanylmethyl]benzoic acid Traditional Name: 4-[[(2-chloro-7-methoxy-3-quinolyl)methylthio]methyl]benzoic acid Formula: C19H16ClNO3S MolecularWeight: 373.85324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)CSCC3=CC=C(C=C3)C(=O)O)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)CSCC3=CC=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C19H16ClNO3S/c1-24-16-7-6-14-8-15(18(20)21-17(14)9-16)11-25-10-12-2-4-13(5-3-12)19(22)23/h2-9H,10-11H2,1H3,(H,22,23)