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

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-6-(4-methoxyphenoxy)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-methoxyphenoxy)pyrimidin-4-yl]-(1,3-benzodioxol-5-yl)amine Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)OC2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N4O4/c1-23-12-3-5-13(6-4-12)26-18-16(19)17(20-9-21-18)22-11-2-7-14-15(8-11)25-10-24-14/h2-9H,10,19H2,1H3,(H,20,21,22)