methyl 2-[4-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methoxy]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methoxy]phenyl]ethanoate Openeye Name: methyl 2-[4-[(2-chloro-7-methylsulfanyl-3-quinolyl)methoxy]phenyl]acetate CAS Name: 2-[4-[[2-chloro-7-(methylthio)-3-quinolinyl]methoxy]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(2-chloro-7-methylsulfanylquinolin-3-yl)methoxy]phenyl]acetate Traditional Name: 2-[4-[[2-chloro-7-(methylthio)-3-quinolyl]methoxy]phenyl]acetic acid methyl ester Formula: C20H18ClNO3S MolecularWeight: 387.87982

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)OCC2=C(N=C3C=C(C=CC3=C2)SC)Cl

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)OCC2=C(N=C3C=C(C=CC3=C2)SC)Cl

InChI

InChI=1S/C20H18ClNO3S/c1-24-19(23)9-13-3-6-16(7-4-13)25-12-15-10-14-5-8-17(26-2)11-18(14)22-20(15)21/h3-8,10-11H,9,12H2,1-2H3