(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 2-(2-oxo-1,3-benzoxazol-3-yl)acetate CAS Name: 2-(2-oxo-1,3-benzoxazol-3-yl)acetic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 2-(2-oxo-1,3-benzoxazol-3-yl)acetate Traditional Name: 2-(2-keto-1,3-benzoxazol-3-yl)acetic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C20H15ClN2O4S MolecularWeight: 414.8621

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)CN3C4=CC=CC=C4OC3=O)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)CN3C4=CC=CC=C4OC3=O)Cl

InChI

InChI=1S/C20H15ClN2O4S/c1-28-14-7-6-12-8-13(19(21)22-15(12)9-14)11-26-18(24)10-23-16-4-2-3-5-17(16)27-20(23)25/h2-9H,10-11H2,1H3