5-methyl-4-nitro-N-(4-phenylbutyl)-1H-pyrazol-3-amine

Systemtic Name: 5-methyl-4-nitro-N-(4-phenylbutyl)-1H-pyrazol-3-amine Openeye Name: 5-methyl-4-nitro-N-(4-phenylbutyl)-1H-pyrazol-3-amine CAS Name: 5-methyl-4-nitro-N-(4-phenylbutyl)-1H-pyrazol-3-amine IUPAC Name: 5-methyl-4-nitro-N-(4-phenylbutyl)-1H-pyrazol-3-amine Traditional Name: (5-methyl-4-nitro-1H-pyrazol-3-yl)-(4-phenylbutyl)amine Formula: C14H18N4O2 MolecularWeight: 274.31832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)NCCCCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)NCCCCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O2/c1-11-13(18(19)20)14(17-16-11)15-10-6-5-9-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-10H2,1H3,(H2,15,16,17)