1-(2-methyl-5-nitro-phenyl)sulfonyl-N-quinolin-3-yl-piperidine-4-carboxamide

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-quinolin-3-yl-piperidine-4-carboxamide Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(3-quinolyl)piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(3-quinolinyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-quinolin-3-ylpiperidine-4-carboxamide Traditional Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(3-quinolyl)isonipecotamide Formula: C22H22N4O5S MolecularWeight: 454.49888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C22H22N4O5S/c1-15-6-7-19(26(28)29)13-21(15)32(30,31)25-10-8-16(9-11-25)22(27)24-18-12-17-4-2-3-5-20(17)23-14-18/h2-7,12-14,16H,8-11H2,1H3,(H,24,27)