N-butyl-N-methyl-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-butyl-N-methyl-1-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-butyl-N-methyl-1-(3-nitro-4-pyrrolidin-1-yl-benzoyl)piperidine-4-carboxamide CAS Name: N-butyl-N-methyl-1-[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-butyl-N-methyl-1-(3-nitro-4-pyrrolidin-1-ylbenzoyl)piperidine-4-carboxamide Traditional Name: N-butyl-N-methyl-1-(3-nitro-4-pyrrolidino-benzoyl)isonipecotamide Formula: C22H32N4O4 MolecularWeight: 416.51388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(C)C(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H32N4O4/c1-3-4-11-23(2)21(27)17-9-14-25(15-10-17)22(28)18-7-8-19(20(16-18)26(29)30)24-12-5-6-13-24/h7-8,16-17H,3-6,9-15H2,1-2H3