ethyl 1-ethyl-6-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-ethyl-6-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-ethyl-6-[(4-methyl-1-piperidyl)sulfonyl]-4-oxo-quinoline-3-carboxylate CAS Name: 1-ethyl-6-[(4-methyl-1-piperidinyl)sulfonyl]-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-6-(4-methylpiperidin-1-yl)sulfonyl-4-oxoquinoline-3-carboxylate Traditional Name: 1-ethyl-4-keto-6-(4-methylpiperidino)sulfonyl-quinoline-3-carboxylic acid ethyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)C(=O)OCC

InChI

InChI=1S/C20H26N2O5S/c1-4-21-13-17(20(24)27-5-2)19(23)16-12-15(6-7-18(16)21)28(25,26)22-10-8-14(3)9-11-22/h6-7,12-14H,4-5,8-11H2,1-3H3