methyl 6-(5-chloranyl-2-phenylmethoxy-phenyl)-3-ethyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 6-(5-chloranyl-2-phenylmethoxy-phenyl)-3-ethyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-(2-benzyloxy-5-chloro-phenyl)-3-ethyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(5-chloro-2-phenylmethoxyphenyl)-3-ethyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(5-chloro-2-phenylmethoxyphenyl)-3-ethyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(2-benzoxy-5-chloro-phenyl)-3-ethyl-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=C(C=CC(=C2)Cl)OCC3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C22H23ClN2O4/c1-4-25-14(2)19(21(26)28-3)20(24-22(25)27)17-12-16(23)10-11-18(17)29-13-15-8-6-5-7-9-15/h5-12,20H,4,13H2,1-3H3,(H,24,27)