methyl 4-(5-chloranyl-2-prop-2-enoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-(5-chloranyl-2-prop-2-enoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 4-(2-allyloxy-5-chloro-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(5-chloro-2-prop-2-enoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(5-chloro-2-prop-2-enoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(2-allyloxy-5-chloro-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=C(C=CC(=C2)Cl)OCC=C)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1)C2=C(C=CC(=C2)Cl)OCC=C)C(=O)OC

InChI

InChI=1S/C16H17ClN2O4/c1-4-7-23-12-6-5-10(17)8-11(12)14-13(15(20)22-3)9(2)18-16(21)19-14/h4-6,8,14H,1,7H2,2-3H3,(H2,18,19,21)