6-[(2-methoxy-5-nitro-phenoxy)methyl]-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(2-methoxy-5-nitro-phenoxy)methyl]-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(2-methoxy-5-nitro-phenoxy)methyl]-N2-(p-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[(2-methoxy-5-nitrophenoxy)methyl]-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(2-methoxy-5-nitrophenoxy)methyl]-2-N-(4-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(2-methoxy-5-nitro-phenoxy)methyl]-s-triazin-2-yl]-(p-tolyl)amine Formula: C18H18N6O4 MolecularWeight: 382.37332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N6O4/c1-11-3-5-12(6-4-11)20-18-22-16(21-17(19)23-18)10-28-15-9-13(24(25)26)7-8-14(15)27-2/h3-9H,10H2,1-2H3,(H3,19,20,21,22,23)