ethyl 1-(1-methyl-4-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-quinolin-3-yl)carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-(1-methyl-4-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-quinolin-3-yl)carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(1-methyl-4-oxo-6-pyrrolidin-1-ylsulfonyl-quinoline-3-carbonyl)piperidine-3-carboxylate CAS Name: 1-[[1-methyl-4-oxo-6-(1-pyrrolidinylsulfonyl)-3-quinolinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-methyl-4-oxo-6-pyrrolidin-1-ylsulfonylquinoline-3-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(4-keto-1-methyl-6-pyrrolidinosulfonyl-quinoline-3-carbonyl)nipecotic acid ethyl ester Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CN(C3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CN(C3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C23H29N3O6S/c1-3-32-23(29)16-7-6-10-25(14-16)22(28)19-15-24(2)20-9-8-17(13-18(20)21(19)27)33(30,31)26-11-4-5-12-26/h8-9,13,15-16H,3-7,10-12,14H2,1-2H3