ethyl 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-methyl-4-oxidanylidene-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-methyl-4-oxidanylidene-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-methyl-4-oxo-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-methyl-4-oxo-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-6-methyl-4-oxofuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-keto-6-methyl-furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H17BrN2O6 MolecularWeight: 449.25208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=O)N(C=N2)CC3=CC4=C(C=C3Br)OCCO4)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=O)N(C=N2)CC3=CC4=C(C=C3Br)OCCO4)C

InChI

InChI=1S/C19H17BrN2O6/c1-3-25-19(24)15-10(2)28-17-16(15)18(23)22(9-21-17)8-11-6-13-14(7-12(11)20)27-5-4-26-13/h6-7,9H,3-5,8H2,1-2H3