methyl 6-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-1-prop-2-enyl-quinoline-3-carboxylate

Systemtic Name: methyl 6-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-1-prop-2-enyl-quinoline-3-carboxylate Openeye Name: methyl 1-allyl-6-[(4-methyl-1-piperidyl)sulfonyl]-4-oxo-quinoline-3-carboxylate CAS Name: 6-[(4-methyl-1-piperidinyl)sulfonyl]-4-oxo-1-prop-2-enyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 6-(4-methylpiperidin-1-yl)sulfonyl-4-oxo-1-prop-2-enylquinoline-3-carboxylate Traditional Name: 1-allyl-4-keto-6-(4-methylpiperidino)sulfonyl-quinoline-3-carboxylic acid methyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C=C(C3=O)C(=O)OC)CC=C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C=C(C3=O)C(=O)OC)CC=C

InChI

InChI=1S/C20H24N2O5S/c1-4-9-21-13-17(20(24)27-3)19(23)16-12-15(5-6-18(16)21)28(25,26)22-10-7-14(2)8-11-22/h4-6,12-14H,1,7-11H2,2-3H3