tert-butyl 3-(3-chlorophenyl)-5-methyl-2,6-bis(oxidanylidene)pyrimidine-1-carboxylate

Systemtic Name: tert-butyl 3-(3-chlorophenyl)-5-methyl-2,6-bis(oxidanylidene)pyrimidine-1-carboxylate Openeye Name: tert-butyl 3-(3-chlorophenyl)-5-methyl-2,6-dioxo-pyrimidine-1-carboxylate CAS Name: 3-(3-chlorophenyl)-5-methyl-2,6-dioxo-1-pyrimidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3-chlorophenyl)-5-methyl-2,6-dioxopyrimidine-1-carboxylate Traditional Name: 3-(3-chlorophenyl)-2,6-diketo-5-methyl-pyrimidine-1-carboxylic acid tert-butyl ester Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)N(C1=O)C(=O)OC(C)(C)C)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=CN(C(=O)N(C1=O)C(=O)OC(C)(C)C)C2=CC(=CC=C2)Cl

InChI

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