N4-(1,3-benzodioxol-5-ylmethyl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-methoxyphenoxy)pyrimidin-4-yl]-piperonyl-amine Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=NC=NC(=C2N)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)OC2=NC=NC(=C2N)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H18N4O4/c1-24-13-3-5-14(6-4-13)27-19-17(20)18(22-10-23-19)21-9-12-2-7-15-16(8-12)26-11-25-15/h2-8,10H,9,11,20H2,1H3,(H,21,22,23)