1-(4-methyl-1,2,4-triazol-3-yl)-N-[(4-nitrophenyl)methyl]ethanamine

Systemtic Name: 1-(4-methyl-1,2,4-triazol-3-yl)-N-[(4-nitrophenyl)methyl]ethanamine Openeye Name: 1-(4-methyl-1,2,4-triazol-3-yl)-N-[(4-nitrophenyl)methyl]ethanamine CAS Name: 1-(4-methyl-1,2,4-triazol-3-yl)-N-[(4-nitrophenyl)methyl]ethanamine IUPAC Name: 1-(4-methyl-1,2,4-triazol-3-yl)-N-[(4-nitrophenyl)methyl]ethanamine Traditional Name: 1-(4-methyl-1,2,4-triazol-3-yl)ethyl-(4-nitrobenzyl)amine Formula: C12H15N5O2 MolecularWeight: 261.2798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=CN1C)NCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C1=NN=CN1C)NCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N5O2/c1-9(12-15-14-8-16(12)2)13-7-10-3-5-11(6-4-10)17(18)19/h3-6,8-9,13H,7H2,1-2H3