methyl 4-[3-iodanyl-5-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-[3-iodanyl-5-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-[4-(2-anilino-2-oxo-ethoxy)-3-iodo-5-methoxy-phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[4-(2-anilino-2-oxoethoxy)-3-iodo-5-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[4-(2-anilino-2-oxoethoxy)-3-iodo-5-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[4-(2-anilino-2-keto-ethoxy)-3-iodo-5-methoxy-phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C22H22IN3O6 MolecularWeight: 551.33105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)I)OCC(=O)NC3=CC=CC=C3)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)I)OCC(=O)NC3=CC=CC=C3)OC)C(=O)OC

InChI

InChI=1S/C22H22IN3O6/c1-12-18(21(28)31-3)19(26-22(29)24-12)13-9-15(23)20(16(10-13)30-2)32-11-17(27)25-14-7-5-4-6-8-14/h4-10,19H,11H2,1-3H3,(H,25,27)(H2,24,26,29)