[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 1-(3-methylquinolin-8-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 1-(3-methylquinolin-8-yl)sulfonylpiperidine-4-carboxylate Openeye Name: [2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 1-[(3-methyl-8-quinolyl)sulfonyl]piperidine-4-carboxylate CAS Name: 1-[(3-methyl-8-quinolinyl)sulfonyl]-4-piperidinecarboxylic acid [2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxo-1-phenylethyl] 1-(3-methylquinolin-8-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-[(3-methyl-8-quinolyl)sulfonyl]isonipecotic acid [2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCC(CC3)C(=O)OC(C4=CC=CC=C4)C(=O)N(C)C

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCC(CC3)C(=O)OC(C4=CC=CC=C4)C(=O)N(C)C

InChI

InChI=1S/C26H29N3O5S/c1-18-16-21-10-7-11-22(23(21)27-17-18)35(32,33)29-14-12-20(13-15-29)26(31)34-24(25(30)28(2)3)19-8-5-4-6-9-19/h4-11,16-17,20,24H,12-15H2,1-3H3