ethyl 2-chloranyl-5-ethoxy-6-oxidanylidene-1-(phenylmethyl)pyrimidine-4-carboxylate

Systemtic Name: ethyl 2-chloranyl-5-ethoxy-6-oxidanylidene-1-(phenylmethyl)pyrimidine-4-carboxylate Openeye Name: ethyl 1-benzyl-2-chloro-5-ethoxy-6-oxo-pyrimidine-4-carboxylate CAS Name: 2-chloro-5-ethoxy-6-oxo-1-(phenylmethyl)-4-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-2-chloro-5-ethoxy-6-oxopyrimidine-4-carboxylate Traditional Name: 1-benzyl-2-chloro-5-ethoxy-6-keto-pyrimidine-4-carboxylic acid ethyl ester Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=C(N(C1=O)CC2=CC=CC=C2)Cl)C(=O)OCC

Isomeric SMILES

CCOC1=C(N=C(N(C1=O)CC2=CC=CC=C2)Cl)C(=O)OCC

InChI

InChI=1S/C16H17ClN2O4/c1-3-22-13-12(15(21)23-4-2)18-16(17)19(14(13)20)10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3