N4-(1,3-benzodioxol-5-yl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-6-(2-methoxyphenoxy)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(2-methoxyphenoxy)pyrimidin-4-yl]-(1,3-benzodioxol-5-yl)amine Formula: C18H16N4O4 MolecularWeight: 352.34404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC=C1OC2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

InChI

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