ethyl 6-[(2-chloranyl-4-phenyl-phenoxy)methyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(2-chloranyl-4-phenyl-phenoxy)methyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(2-chloro-4-phenyl-phenoxy)methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(2-chloro-4-phenylphenoxy)methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(2-chloro-4-phenylphenoxy)methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(2-chloro-4-phenyl-phenoxy)methyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC2=C(C=C(C=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)COC2=C(C=C(C=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O4/c1-3-27-20(25)19-13(2)23-21(26)24-17(19)12-28-18-10-9-15(11-16(18)22)14-7-5-4-6-8-14/h4-11,13H,3,12H2,1-2H3,(H2,23,24,26)