N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-nitro-benzamide

Systemtic Name: N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-nitro-benzamide Openeye Name: N-[1-(2-methylpropanoyl)-4-piperidyl]-4-nitro-benzamide CAS Name: N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-4-nitrobenzamide IUPAC Name: N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-nitrobenzamide Traditional Name: N-(1-isobutyryl-4-piperidyl)-4-nitro-benzamide Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O4/c1-11(2)16(21)18-9-7-13(8-10-18)17-15(20)12-3-5-14(6-4-12)19(22)23/h3-6,11,13H,7-10H2,1-2H3,(H,17,20)