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

Systemtic Name: N-(5-chloranyl-2-methoxy-4-nitro-phenyl)-1-[(4-methylphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-methoxy-4-nitro-phenyl)-1-(p-tolylmethyl)piperidine-4-carboxamide CAS Name: N-(5-chloro-2-methoxy-4-nitrophenyl)-1-[(4-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-methoxy-4-nitrophenyl)-1-[(4-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-methoxy-4-nitro-phenyl)-1-(4-methylbenzyl)isonipecotamide Formula: C21H24ClN3O4 MolecularWeight: 417.88596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(CC2)C(=O)NC3=CC(=C(C=C3OC)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(CC2)C(=O)NC3=CC(=C(C=C3OC)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H24ClN3O4/c1-14-3-5-15(6-4-14)13-24-9-7-16(8-10-24)21(26)23-18-11-17(22)19(25(27)28)12-20(18)29-2/h3-6,11-12,16H,7-10,13H2,1-2H3,(H,23,26)