[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 1-(3-methylquinolin-8-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 1-(3-methylquinolin-8-yl)sulfonylpiperidine-4-carboxylate Openeye Name: [2-(isobutylamino)-1-methyl-2-oxo-ethyl] 1-[(3-methyl-8-quinolyl)sulfonyl]piperidine-4-carboxylate CAS Name: 1-[(3-methyl-8-quinolinyl)sulfonyl]-4-piperidinecarboxylic acid [1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylpropylamino)-1-oxopropan-2-yl] 1-(3-methylquinolin-8-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-[(3-methyl-8-quinolyl)sulfonyl]isonipecotic acid [2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S/c1-15(2)13-25-22(27)17(4)31-23(28)18-8-10-26(11-9-18)32(29,30)20-7-5-6-19-12-16(3)14-24-21(19)20/h5-7,12,14-15,17-18H,8-11,13H2,1-4H3,(H,25,27)