N-(6-methylheptan-2-yl)-1-(4-nitrophenyl)pyrazole-4-carboxamide

Systemtic Name: N-(6-methylheptan-2-yl)-1-(4-nitrophenyl)pyrazole-4-carboxamide Openeye Name: N-(1,5-dimethylhexyl)-1-(4-nitrophenyl)pyrazole-4-carboxamide CAS Name: N-(6-methylheptan-2-yl)-1-(4-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: N-(6-methylheptan-2-yl)-1-(4-nitrophenyl)pyrazole-4-carboxamide Traditional Name: N-(1,5-dimethylhexyl)-1-(4-nitrophenyl)pyrazole-4-carboxamide Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O3/c1-13(2)5-4-6-14(3)20-18(23)15-11-19-21(12-15)16-7-9-17(10-8-16)22(24)25/h7-14H,4-6H2,1-3H3,(H,20,23)