ethyl 4-(1,3-benzodioxol-5-ylmethylamino)-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-ylmethylamino)-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-ylmethylamino)-2,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2,6-dimethyl-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-ylmethylamino)-2,6-dimethylfuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 2,6-dimethyl-4-(piperonylamino)furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H19N3O5 MolecularWeight: 369.37126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)NCC3=CC4=C(C=C3)OCO4)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)NCC3=CC4=C(C=C3)OCO4)C)C

InChI

InChI=1S/C19H19N3O5/c1-4-24-19(23)15-10(2)27-18-16(15)17(21-11(3)22-18)20-8-12-5-6-13-14(7-12)26-9-25-13/h5-7H,4,8-9H2,1-3H3,(H,20,21,22)