1-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[4-(3-methyl-1-piperidyl)-3-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[4-(3-methyl-1-piperidinyl)-3-nitrophenyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[4-(3-methylpiperidin-1-yl)-3-nitrophenyl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: [4-(3-methylpiperidino)-3-nitro-benzylidene]-(1,2,4-triazol-4-yl)amine Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C=NN3C=NN=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C=NN3C=NN=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O2/c1-12-3-2-6-19(9-12)14-5-4-13(7-15(14)21(22)23)8-18-20-10-16-17-11-20/h4-5,7-8,10-12H,2-3,6,9H2,1H3