N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[1-(2,2-dimethylpropanoyl)-4-piperidyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[1-(2,2-dimethyl-1-oxopropyl)-4-piperidinyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-(3-nitrophenyl)-N-(1-pivaloyl-4-piperidyl)pyrazole-3-carboxamide Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC(CC1)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)N1CCC(CC1)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O4/c1-20(2,3)19(27)23-10-7-14(8-11-23)21-18(26)17-9-12-24(22-17)15-5-4-6-16(13-15)25(28)29/h4-6,9,12-14H,7-8,10-11H2,1-3H3,(H,21,26)