(4-methylsulfanylphenyl)methyl 2-methylquinoline-4-carboxylate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-methylquinoline-4-carboxylate Openeye Name: (4-methylsulfanylphenyl)methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [4-(methylthio)benzyl] ester Formula: C19H17NO2S MolecularWeight: 323.40878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=CC=C(C=C3)SC

InChI

InChI=1S/C19H17NO2S/c1-13-11-17(16-5-3-4-6-18(16)20-13)19(21)22-12-14-7-9-15(23-2)10-8-14/h3-11H,12H2,1-2H3