N-methyl-4-[3-(4-nitrophenyl)-1H-pyrazol-5-yl]butan-1-amine

Systemtic Name: N-methyl-4-[3-(4-nitrophenyl)-1H-pyrazol-5-yl]butan-1-amine Openeye Name: N-methyl-4-[3-(4-nitrophenyl)-1H-pyrazol-5-yl]butan-1-amine CAS Name: N-methyl-4-[3-(4-nitrophenyl)-1H-pyrazol-5-yl]-1-butanamine IUPAC Name: N-methyl-4-[3-(4-nitrophenyl)-1H-pyrazol-5-yl]butan-1-amine Traditional Name: methyl-[4-[3-(4-nitrophenyl)-1H-pyrazol-5-yl]butyl]amine Formula: C14H18N4O2 MolecularWeight: 274.31832

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCC1=CC(=NN1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CNCCCCC1=CC(=NN1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O2/c1-15-9-3-2-4-12-10-14(17-16-12)11-5-7-13(8-6-11)18(19)20/h5-8,10,15H,2-4,9H2,1H3,(H,16,17)