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

Systemtic Name: N-[[2-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]-1-phenyl-methanamine Openeye Name: N-[[2-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]-1-phenyl-methanamine CAS Name: N-[[2-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]-1-phenylmethanamine IUPAC Name: N-[[2-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]-1-phenylmethanamine Traditional Name: benzyl-[[2-(4-nitrophenyl)-1,2,4-triazol-3-yl]methyl]amine Formula: C16H15N5O2 MolecularWeight: 309.3226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC2=NC=NN2C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNCC2=NC=NN2C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O2/c22-21(23)15-8-6-14(7-9-15)20-16(18-12-19-20)11-17-10-13-4-2-1-3-5-13/h1-9,12,17H,10-11H2