(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 5,6,7,8-tetrahydronaphthalene-2-carboxylate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 5,6,7,8-tetrahydronaphthalene-2-carboxylate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl tetralin-6-carboxylate CAS Name: 5,6,7,8-tetrahydronaphthalene-2-carboxylic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 5,6,7,8-tetrahydronaphthalene-2-carboxylate Traditional Name: tetralin-6-carboxylic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C22H20ClNO2S MolecularWeight: 397.9177

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC4=C(CCCC4)C=C3)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC4=C(CCCC4)C=C3)Cl

InChI

InChI=1S/C22H20ClNO2S/c1-27-19-9-8-16-11-18(21(23)24-20(16)12-19)13-26-22(25)17-7-6-14-4-2-3-5-15(14)10-17/h6-12H,2-5,13H2,1H3