N-[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridinyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]-1-(2-nitrophenyl)isonipecotamide Formula: C22H24N6O3 MolecularWeight: 420.46436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC=C(C=C2)NC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=NC=C(C=C2)NC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-])C

InChI

InChI=1S/C22H24N6O3/c1-15-13-16(2)27(25-15)21-8-7-18(14-23-21)24-22(29)17-9-11-26(12-10-17)19-5-3-4-6-20(19)28(30)31/h3-8,13-14,17H,9-12H2,1-2H3,(H,24,29)