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

Systemtic Name: 6-[(4-chloranyl-2-nitro-phenoxy)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-chloro-2-nitro-phenoxy)methyl]-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[(4-chloro-2-nitrophenoxy)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4-chloro-2-nitrophenoxy)methyl]-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(4-chloro-2-nitro-phenoxy)methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C17H15ClN6O3 MolecularWeight: 386.7924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN6O3/c1-10-4-2-3-5-12(10)20-17-22-15(21-16(19)23-17)9-27-14-7-6-11(18)8-13(14)24(25)26/h2-8H,9H2,1H3,(H3,19,20,21,22,23)