3-nitro-N2-(phenylmethyl)pyridine-2,4-diamine

Systemtic Name: 3-nitro-N2-(phenylmethyl)pyridine-2,4-diamine Openeye Name: N2-benzyl-3-nitro-pyridine-2,4-diamine CAS Name: 3-nitro-N2-(phenylmethyl)pyridine-2,4-diamine IUPAC Name: 2-N-benzyl-3-nitropyridine-2,4-diamine Traditional Name: (4-amino-3-nitro-2-pyridyl)-benzyl-amine Formula: C12H12N4O2 MolecularWeight: 244.24928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O2/c13-10-6-7-14-12(11(10)16(17)18)15-8-9-4-2-1-3-5-9/h1-7H,8H2,(H3,13,14,15)