methyl (4R)-4-(2-butoxy-5-iodanyl-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-4-(2-butoxy-5-iodanyl-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-4-(2-butoxy-5-iodo-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(2-butoxy-5-iodophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-4-(2-butoxy-5-iodophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(2-butoxy-5-iodo-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C17H21IN2O4 MolecularWeight: 444.26411

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)I)C2C(=C(NC(=O)N2)C)C(=O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)I)[C@@H]2C(=C(NC(=O)N2)C)C(=O)OC

InChI

InChI=1S/C17H21IN2O4/c1-4-5-8-24-13-7-6-11(18)9-12(13)15-14(16(21)23-3)10(2)19-17(22)20-15/h6-7,9,15H,4-5,8H2,1-3H3,(H2,19,20,22)/t15-/m1/s1