methyl 4-methyl-2-[(4-methylsulfanylphenoxy)methyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[(4-methylsulfanylphenoxy)methyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[(4-methylsulfanylphenoxy)methyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[4-(methylthio)phenoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(4-methylsulfanylphenoxy)methyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[4-(methylthio)phenoxy]methyl]quinoline-3-carboxylic acid methyl ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC3=CC=C(C=C3)SC)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC3=CC=C(C=C3)SC)C(=O)OC

InChI

InChI=1S/C20H19NO3S/c1-13-16-6-4-5-7-17(16)21-18(19(13)20(22)23-2)12-24-14-8-10-15(25-3)11-9-14/h4-11H,12H2,1-3H3