N-hexyl-1-(4-nitrophenyl)pyrazole-4-carboxamide

Systemtic Name: N-hexyl-1-(4-nitrophenyl)pyrazole-4-carboxamide Openeye Name: N-hexyl-1-(4-nitrophenyl)pyrazole-4-carboxamide CAS Name: N-hexyl-1-(4-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: N-hexyl-1-(4-nitrophenyl)pyrazole-4-carboxamide Traditional Name: N-hexyl-1-(4-nitrophenyl)pyrazole-4-carboxamide Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CN(N=C1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCNC(=O)C1=CN(N=C1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O3/c1-2-3-4-5-10-17-16(21)13-11-18-19(12-13)14-6-8-15(9-7-14)20(22)23/h6-9,11-12H,2-5,10H2,1H3,(H,17,21)