(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 1-oxidanylnaphthalene-2-carboxylate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 1-oxidanylnaphthalene-2-carboxylate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 1-hydroxynaphthalene-2-carboxylate CAS Name: 1-hydroxy-2-naphthalenecarboxylic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 1-hydroxynaphthalene-2-carboxylate Traditional Name: 1-hydroxynaphthalene-2-carboxylic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C22H16ClNO3S MolecularWeight: 409.88534

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=C(C4=CC=CC=C4C=C3)O)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=C(C4=CC=CC=C4C=C3)O)Cl

InChI

InChI=1S/C22H16ClNO3S/c1-28-16-8-6-14-10-15(21(23)24-19(14)11-16)12-27-22(26)18-9-7-13-4-2-3-5-17(13)20(18)25/h2-11,25H,12H2,1H3