ethyl 4-azanyl-6-methyl-2-[(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)carbonyloxymethyl]furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-6-methyl-2-[(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)carbonyloxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-[(2-methyl-2,3-dihydro-1,4-benzodioxine-3-carbonyl)oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[[(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-oxomethoxy]methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-[(2-methyl-2,3-dihydro-1,4-benzodioxine-3-carbonyl)oxymethyl]furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-6-methyl-2-[(2-methyl-2,3-dihydro-1,4-benzodioxin-3-carbonyl)oxymethyl]furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C21H21N3O7 MolecularWeight: 427.40734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3C(OC4=CC=CC=C4O3)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)COC(=O)C3C(OC4=CC=CC=C4O3)C)C

InChI

InChI=1S/C21H21N3O7/c1-4-27-20(25)15-10(2)30-19-16(15)18(22)23-14(24-19)9-28-21(26)17-11(3)29-12-7-5-6-8-13(12)31-17/h5-8,11,17H,4,9H2,1-3H3,(H2,22,23,24)