N2-(4-methylphenyl)-6-[(2-nitropyridin-3-yl)oxymethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(4-methylphenyl)-6-[(2-nitropyridin-3-yl)oxymethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(2-nitro-3-pyridyl)oxymethyl]-N2-(p-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-methylphenyl)-6-[(2-nitro-3-pyridinyl)oxymethyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-methylphenyl)-6-[(2-nitropyridin-3-yl)oxymethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(2-nitro-3-pyridyl)oxymethyl]-s-triazin-2-yl]-(p-tolyl)amine Formula: C16H15N7O3 MolecularWeight: 353.3354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC3=C(N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC3=C(N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N7O3/c1-10-4-6-11(7-5-10)19-16-21-13(20-15(17)22-16)9-26-12-3-2-8-18-14(12)23(24)25/h2-8H,9H2,1H3,(H3,17,19,20,21,22)