N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1-(2-methyl-1-oxopropyl)-3-piperidinecarboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-isobutyryl-nipecotamide Formula: C20H29N3O6 MolecularWeight: 407.46076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CC(C)C(=O)N1CCCC(C1)C(=O)NCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H29N3O6/c1-13(2)20(25)22-9-5-6-15(12-22)19(24)21-8-7-14-10-17(28-3)18(29-4)11-16(14)23(26)27/h10-11,13,15H,5-9,12H2,1-4H3,(H,21,24)