N-[cyclopropyl-(4-methylphenyl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[cyclopropyl-(4-methylphenyl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[cyclopropyl(p-tolyl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[cyclopropyl-(4-methylphenyl)methyl]-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[cyclopropyl-(4-methylphenyl)methyl]-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[cyclopropyl(p-tolyl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C24H29N3O5S MolecularWeight: 471.56916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])C

InChI

InChI=1S/C24H29N3O5S/c1-16-3-6-18(7-4-16)23(19-8-9-19)25-24(28)20-11-13-26(14-12-20)33(31,32)22-15-21(27(29)30)10-5-17(22)2/h3-7,10,15,19-20,23H,8-9,11-14H2,1-2H3,(H,25,28)