N-(2-methoxy-5-methyl-phenyl)-1-(2-nitrophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-1-(2-nitrophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-1-(2-nitrophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-methoxy-5-methylphenyl)-1-(2-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-1-(2-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-1-(2-nitrophenyl)sulfonyl-isonipecotamide Formula: C20H23N3O6S MolecularWeight: 433.47812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6S/c1-14-7-8-18(29-2)16(13-14)21-20(24)15-9-11-22(12-10-15)30(27,28)19-6-4-3-5-17(19)23(25)26/h3-8,13,15H,9-12H2,1-2H3,(H,21,24)