N-[1-(4-butan-2-ylphenyl)propyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: 2,5-dimethyl-4-nitro-N-[1-(4-sec-butylphenyl)propyl]pyrazole-3-carboxamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: 2,5-dimethyl-4-nitro-N-[1-(4-sec-butylphenyl)propyl]pyrazole-3-carboxamide Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=C(C(=NN2C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=C(C(=NN2C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H26N4O3/c1-6-12(3)14-8-10-15(11-9-14)16(7-2)20-19(24)18-17(23(25)26)13(4)21-22(18)5/h8-12,16H,6-7H2,1-5H3,(H,20,24)