4-nitro-N3-(phenylmethyl)pyridine-3,5-diamine

Systemtic Name: 4-nitro-N3-(phenylmethyl)pyridine-3,5-diamine Openeye Name: N3-benzyl-4-nitro-pyridine-3,5-diamine CAS Name: 4-nitro-N3-(phenylmethyl)pyridine-3,5-diamine IUPAC Name: 3-N-benzyl-4-nitropyridine-3,5-diamine Traditional Name: (5-amino-4-nitro-3-pyridyl)-benzyl-amine Formula: C12H12N4O2 MolecularWeight: 244.24928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=CN=C2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=CN=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O2/c13-10-7-14-8-11(12(10)16(17)18)15-6-9-4-2-1-3-5-9/h1-5,7-8,15H,6,13H2