(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C19H16Cl2N2O3S MolecularWeight: 423.31294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC2=C(N=C3C=C(C=CC3=C2)SC)Cl)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC2=C(N=C3C=C(C=CC3=C2)SC)Cl)Cl)N

InChI

InChI=1S/C19H16Cl2N2O3S/c1-25-17-8-15(22)14(20)7-13(17)19(24)26-9-11-5-10-3-4-12(27-2)6-16(10)23-18(11)21/h3-8H,9,22H2,1-2H3