N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-(3-nitropyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-(3-nitropyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-(3-nitro-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-(3-nitro-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-(3-nitropyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-(3-nitro-2-pyridyl)isonipecotamide Formula: C18H29N5O3 MolecularWeight: 363.45456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1CCN(CC1)C2=C(C=CC=N2)[N+](=O)[O-])CN(C)C

Isomeric SMILES

CC(C)(CNC(=O)C1CCN(CC1)C2=C(C=CC=N2)[N+](=O)[O-])CN(C)C

InChI

InChI=1S/C18H29N5O3/c1-18(2,13-21(3)4)12-20-17(24)14-7-10-22(11-8-14)16-15(23(25)26)6-5-9-19-16/h5-6,9,14H,7-8,10-13H2,1-4H3,(H,20,24)