N-(4-methyl-3-nitro-phenyl)-1-(2-methylpropanoyl)piperidine-3-carboxamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-1-(2-methylpropanoyl)piperidine-3-carboxamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-1-(2-methylpropanoyl)piperidine-3-carboxamide CAS Name: N-(4-methyl-3-nitrophenyl)-1-(2-methyl-1-oxopropyl)-3-piperidinecarboxamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-1-(2-methylpropanoyl)piperidine-3-carboxamide Traditional Name: 1-isobutyryl-N-(4-methyl-3-nitro-phenyl)nipecotamide Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O4/c1-11(2)17(22)19-8-4-5-13(10-19)16(21)18-14-7-6-12(3)15(9-14)20(23)24/h6-7,9,11,13H,4-5,8,10H2,1-3H3,(H,18,21)