[7-(3-chloranylpropanoyl)-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl] methanesulfonate

Systemtic Name: [7-(3-chloranylpropanoyl)-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl] methanesulfonate Openeye Name: [7-(3-chloropropanoyl)-2-oxo-3,4-dihydro-1H-quinolin-6-yl] methanesulfonate CAS Name: methanesulfonic acid [7-(3-chloro-1-oxopropyl)-2-oxo-3,4-dihydro-1H-quinolin-6-yl] ester IUPAC Name: [7-(3-chloropropanoyl)-2-oxo-3,4-dihydro-1H-quinolin-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [7-(3-chloropropanoyl)-2-keto-3,4-dihydro-1H-quinolin-6-yl] ester Formula: C13H14ClNO5S MolecularWeight: 331.77196

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=C1C(=O)CCCl)NC(=O)CC2

Isomeric SMILES

CS(=O)(=O)OC1=CC2=C(C=C1C(=O)CCCl)NC(=O)CC2

InChI

InChI=1S/C13H14ClNO5S/c1-21(18,19)20-12-6-8-2-3-13(17)15-10(8)7-9(12)11(16)4-5-14/h6-7H,2-5H2,1H3,(H,15,17)