4-nitro-N-(pyridin-4-ylmethyl)aniline; 1H-1,2,4-triazole

Systemtic Name: 4-nitro-N-(pyridin-4-ylmethyl)aniline; 1H-1,2,4-triazole Openeye Name: 4-nitro-N-(4-pyridylmethyl)aniline; 1H-1,2,4-triazole CAS Name: 4-nitro-N-(pyridin-4-ylmethyl)aniline; 1H-1,2,4-triazole IUPAC Name: 4-nitro-N-(pyridin-4-ylmethyl)aniline; 1H-1,2,4-triazole Traditional Name: (4-nitrophenyl)-(4-pyridylmethyl)amine; 1H-1,2,4-triazole Formula: C14H14N6O2 MolecularWeight: 298.29996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=CC=NC=C2)[N+](=O)[O-].C1=NC=NN1

Isomeric SMILES

C1=CC(=CC=C1NCC2=CC=NC=C2)[N+](=O)[O-].C1=NC=NN1

InChI

InChI=1S/C12H11N3O2.C2H3N3/c16-15(17)12-3-1-11(2-4-12)14-9-10-5-7-13-8-6-10;1-3-2-5-4-1/h1-8,14H,9H2;1-2H,(H,3,4,5)