O1-tert-butyl O3-ethyl 5-bromanyl-2-oxidanylidene-benzimidazole-1,3-dicarboxylate

Systemtic Name: O1-tert-butyl O3-ethyl 5-bromanyl-2-oxidanylidene-benzimidazole-1,3-dicarboxylate Openeye Name: O1-tert-butyl O3-ethyl 5-bromo-2-oxo-benzimidazole-1,3-dicarboxylate CAS Name: 5-bromo-2-oxobenzimidazole-1,3-dicarboxylic acid O1-tert-butyl ester O3-ethyl ester IUPAC Name: 1-O-tert-butyl 3-O-ethyl 5-bromo-2-oxobenzimidazole-1,3-dicarboxylate Traditional Name: 5-bromo-2-keto-benzimidazole-1,3-dicarboxylic acid O1-tert-butyl ester O3-ethyl ester Formula: C15H17BrN2O5 MolecularWeight: 385.20988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C=CC(=C2)Br)N(C1=O)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)N1C2=C(C=CC(=C2)Br)N(C1=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H17BrN2O5/c1-5-22-13(20)18-11-8-9(16)6-7-10(11)17(12(18)19)14(21)23-15(2,3)4/h6-8H,5H2,1-4H3