ethyl 4-(2-bromanylethanoyl)-6-chloranyl-2,5,7,8-tetramethyl-3H-1,4-benzoxazine-2-carboxylate

Systemtic Name: ethyl 4-(2-bromanylethanoyl)-6-chloranyl-2,5,7,8-tetramethyl-3H-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 4-(2-bromoacetyl)-6-chloro-2,5,7,8-tetramethyl-3H-1,4-benzoxazine-2-carboxylate CAS Name: 4-(2-bromo-1-oxoethyl)-6-chloro-2,5,7,8-tetramethyl-3H-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-bromoacetyl)-6-chloro-2,5,7,8-tetramethyl-3H-1,4-benzoxazine-2-carboxylate Traditional Name: 4-(2-bromoacetyl)-6-chloro-2,5,7,8-tetramethyl-3H-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C17H21BrClNO4 MolecularWeight: 418.70994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CN(C2=C(O1)C(=C(C(=C2C)Cl)C)C)C(=O)CBr)C

Isomeric SMILES

CCOC(=O)C1(CN(C2=C(O1)C(=C(C(=C2C)Cl)C)C)C(=O)CBr)C

InChI

InChI=1S/C17H21BrClNO4/c1-6-23-16(22)17(5)8-20(12(21)7-18)14-11(4)13(19)9(2)10(3)15(14)24-17/h6-8H2,1-5H3