1-[1-(2-chloranyl-4-nitro-phenyl)carbonylpiperidin-4-yl]-N-(2-methylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-[1-(2-chloranyl-4-nitro-phenyl)carbonylpiperidin-4-yl]-N-(2-methylpropyl)piperidine-4-carboxamide Openeye Name: 1-[1-(2-chloro-4-nitro-benzoyl)-4-piperidyl]-N-isobutyl-piperidine-4-carboxamide CAS Name: 1-[1-[(2-chloro-4-nitrophenyl)-oxomethyl]-4-piperidinyl]-N-(2-methylpropyl)-4-piperidinecarboxamide IUPAC Name: 1-[1-(2-chloro-4-nitrobenzoyl)piperidin-4-yl]-N-(2-methylpropyl)piperidine-4-carboxamide Traditional Name: 1-[1-(2-chloro-4-nitro-benzoyl)-4-piperidyl]-N-isobutyl-isonipecotamide Formula: C22H31ClN4O4 MolecularWeight: 450.95894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1CCN(CC1)C2CCN(CC2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CNC(=O)C1CCN(CC1)C2CCN(CC2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H31ClN4O4/c1-15(2)14-24-21(28)16-5-9-25(10-6-16)17-7-11-26(12-8-17)22(29)19-4-3-18(27(30)31)13-20(19)23/h3-4,13,15-17H,5-12,14H2,1-2H3,(H,24,28)