O1-tert-butyl O2-ethyl 3-bromanylindole-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-ethyl 3-bromanylindole-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-ethyl 3-bromoindole-1,2-dicarboxylate CAS Name: 3-bromoindole-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester IUPAC Name: 1-O-tert-butyl 2-O-ethyl 3-bromoindole-1,2-dicarboxylate Traditional Name: 3-bromoindole-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester Formula: C16H18BrNO4 MolecularWeight: 368.22242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1C(=O)OC(C)(C)C)Br

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1C(=O)OC(C)(C)C)Br

InChI

InChI=1S/C16H18BrNO4/c1-5-21-14(19)13-12(17)10-8-6-7-9-11(10)18(13)15(20)22-16(2,3)4/h6-9H,5H2,1-4H3