ethyl 4-azanyl-3-bromanyl-2,4-bis(oxidanylidene)-3-(2,4,6-trimethylphenyl)butanoate

Systemtic Name: ethyl 4-azanyl-3-bromanyl-2,4-bis(oxidanylidene)-3-(2,4,6-trimethylphenyl)butanoate Openeye Name: ethyl 4-amino-3-bromo-2,4-dioxo-3-(2,4,6-trimethylphenyl)butanoate CAS Name: 4-amino-3-bromo-2,4-dioxo-3-(2,4,6-trimethylphenyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-amino-3-bromo-2,4-dioxo-3-(2,4,6-trimethylphenyl)butanoate Traditional Name: 4-amino-3-bromo-2,4-diketo-3-mesityl-butyric acid ethyl ester Formula: C15H18BrNO4 MolecularWeight: 356.21172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C(C1=C(C=C(C=C1C)C)C)(C(=O)N)Br

Isomeric SMILES

CCOC(=O)C(=O)C(C1=C(C=C(C=C1C)C)C)(C(=O)N)Br

InChI

InChI=1S/C15H18BrNO4/c1-5-21-13(19)12(18)15(16,14(17)20)11-9(3)6-8(2)7-10(11)4/h6-7H,5H2,1-4H3,(H2,17,20)