ethyl 2-[(3,4-dichlorophenyl)methyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[(3,4-dichlorophenyl)methyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[(3,4-dichlorophenyl)methyl]-6-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-[(3,4-dichlorophenyl)methyl]-6-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3,4-dichlorophenyl)methyl]-6-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-(3,4-dichlorobenzyl)-6-keto-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H12Cl2N2O3 MolecularWeight: 327.16268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(NC1=O)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C(NC1=O)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H12Cl2N2O3/c1-2-21-14(20)9-7-17-12(18-13(9)19)6-8-3-4-10(15)11(16)5-8/h3-5,7H,2,6H2,1H3,(H,17,18,19)