ethyl 1-(6-pyrrolidin-1-ylsulfonylquinolin-2-yl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(6-pyrrolidin-1-ylsulfonylquinolin-2-yl)piperidine-4-carboxylate Openeye Name: ethyl 1-(6-pyrrolidin-1-ylsulfonyl-2-quinolyl)piperidine-4-carboxylate CAS Name: 1-[6-(1-pyrrolidinylsulfonyl)-2-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-pyrrolidin-1-ylsulfonylquinolin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(6-pyrrolidinosulfonyl-2-quinolyl)isonipecotic acid ethyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC3=C(C=C2)C=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC3=C(C=C2)C=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H27N3O4S/c1-2-28-21(25)16-9-13-23(14-10-16)20-8-5-17-15-18(6-7-19(17)22-20)29(26,27)24-11-3-4-12-24/h5-8,15-16H,2-4,9-14H2,1H3