ethanoic acid; methyl 4-(2-chloranyl-5-ethoxy-4-methoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethanoic acid; methyl 4-(2-chloranyl-5-ethoxy-4-methoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: acetic acid; methyl 4-(2-chloro-5-ethoxy-4-methoxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: acetic acid; 4-(2-chloro-5-ethoxy-4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: acetic acid; methyl 4-(2-chloro-5-ethoxy-4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: acetic acid; 4-(2-chloro-5-ethoxy-4-methoxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C18H23ClN2O7 MolecularWeight: 414.83742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2C(=C(NC(=O)N2)C)C(=O)OC)Cl)OC.CC(=O)O

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C2C(=C(NC(=O)N2)C)C(=O)OC)Cl)OC.CC(=O)O

InChI

InChI=1S/C16H19ClN2O5.C2H4O2/c1-5-24-12-6-9(10(17)7-11(12)22-3)14-13(15(20)23-4)8(2)18-16(21)19-14;1-2(3)4/h6-7,14H,5H2,1-4H3,(H2,18,19,21);1H3,(H,3,4)