tert-butyl 5-bromanyl-2,4-bis(oxidanylidene)-3-(phenylmethyl)pyrimidine-1-carboxylate

Systemtic Name: tert-butyl 5-bromanyl-2,4-bis(oxidanylidene)-3-(phenylmethyl)pyrimidine-1-carboxylate Openeye Name: tert-butyl 3-benzyl-5-bromo-2,4-dioxo-pyrimidine-1-carboxylate CAS Name: 5-bromo-2,4-dioxo-3-(phenylmethyl)-1-pyrimidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-benzyl-5-bromo-2,4-dioxopyrimidine-1-carboxylate Traditional Name: 3-benzyl-5-bromo-2,4-diketo-pyrimidine-1-carboxylic acid tert-butyl ester Formula: C16H17BrN2O4 MolecularWeight: 381.22118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C(=O)N(C1=O)CC2=CC=CC=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C(=O)N(C1=O)CC2=CC=CC=C2)Br

InChI

InChI=1S/C16H17BrN2O4/c1-16(2,3)23-15(22)19-10-12(17)13(20)18(14(19)21)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3