tert-butyl 3,4-bis(bromanyl)indole-1-carboxylate

Systemtic Name: tert-butyl 3,4-bis(bromanyl)indole-1-carboxylate Openeye Name: tert-butyl 3,4-dibromoindole-1-carboxylate CAS Name: 3,4-dibromo-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3,4-dibromoindole-1-carboxylate Traditional Name: 3,4-dibromoindole-1-carboxylic acid tert-butyl ester Formula: C13H13Br2NO2 MolecularWeight: 375.05582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC=C2Br)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC=C2Br)Br

InChI

InChI=1S/C13H13Br2NO2/c1-13(2,3)18-12(17)16-7-9(15)11-8(14)5-4-6-10(11)16/h4-7H,1-3H3