6-(1,3-benzodioxol-5-yloxymethyl)-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(1,3-benzodioxol-5-yloxymethyl)-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(1,3-benzodioxol-5-yloxymethyl)-N2-(p-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-(1,3-benzodioxol-5-yloxymethyl)-N2-(4-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(1,3-benzodioxol-5-yloxymethyl)-2-N-(4-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(1,3-benzodioxol-5-yloxymethyl)-s-triazin-2-yl]-(p-tolyl)amine Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17N5O3/c1-11-2-4-12(5-3-11)20-18-22-16(21-17(19)23-18)9-24-13-6-7-14-15(8-13)26-10-25-14/h2-8H,9-10H2,1H3,(H3,19,20,21,22,23)