methyl 2-(7-chloranyl-3-methylsulfonyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-4-yl)ethanoate

Systemtic Name: methyl 2-(7-chloranyl-3-methylsulfonyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-4-yl)ethanoate Openeye Name: methyl 2-(7-chloro-3-methylsulfonyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetate CAS Name: 2-(7-chloro-3-methylsulfonyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetic acid methyl ester IUPAC Name: methyl 2-(7-chloro-3-methylsulfonyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetate Traditional Name: 2-(7-chloro-2-keto-3-mesyl-3,4-dihydro-1H-quinolin-4-yl)acetic acid methyl ester Formula: C13H14ClNO5S MolecularWeight: 331.77196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(C(=O)NC2=C1C=CC(=C2)Cl)S(=O)(=O)C

Isomeric SMILES

COC(=O)CC1C(C(=O)NC2=C1C=CC(=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C13H14ClNO5S/c1-20-11(16)6-9-8-4-3-7(14)5-10(8)15-13(17)12(9)21(2,18)19/h3-5,9,12H,6H2,1-2H3,(H,15,17)