ethyl 6-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-4-methyl-2-oxidanylidene-3-phenethyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-4-methyl-2-oxidanylidene-3-phenethyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-hydroxy-3-iodo-5-methoxy-phenyl)-4-methyl-2-oxo-3-phenethyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-hydroxy-3-iodo-5-methoxyphenyl)-4-methyl-2-oxo-3-phenethyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-hydroxy-3-iodo-5-methoxyphenyl)-4-methyl-2-oxo-3-phenethyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-hydroxy-3-iodo-5-methoxy-phenyl)-2-keto-4-methyl-3-phenethyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H25IN2O5 MolecularWeight: 536.35947

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=C(C(=C2)I)O)OC)CCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=C(C(=C2)I)O)OC)CCC3=CC=CC=C3)C

InChI

InChI=1S/C23H25IN2O5/c1-4-31-22(28)19-14(2)26(11-10-15-8-6-5-7-9-15)23(29)25-20(19)16-12-17(24)21(27)18(13-16)30-3/h5-9,12-13,20,27H,4,10-11H2,1-3H3,(H,25,29)