tert-butyl 3-bromanyl-5-(bromomethyl)-2-(2-methoxycarbonylphenyl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-bromanyl-5-(bromomethyl)-2-(2-methoxycarbonylphenyl)indole-1-carboxylate Openeye Name: tert-butyl 3-bromo-5-(bromomethyl)-2-(2-methoxycarbonylphenyl)indole-1-carboxylate CAS Name: 3-bromo-5-(bromomethyl)-2-(2-methoxycarbonylphenyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-bromo-5-(bromomethyl)-2-(2-methoxycarbonylphenyl)indole-1-carboxylate Traditional Name: 3-bromo-5-(bromomethyl)-2-(2-carbomethoxyphenyl)indole-1-carboxylic acid tert-butyl ester Formula: C22H21Br2NO4 MolecularWeight: 523.21444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)CBr)C(=C1C3=CC=CC=C3C(=O)OC)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)CBr)C(=C1C3=CC=CC=C3C(=O)OC)Br

InChI

InChI=1S/C22H21Br2NO4/c1-22(2,3)29-21(27)25-17-10-9-13(12-23)11-16(17)18(24)19(25)14-7-5-6-8-15(14)20(26)28-4/h5-11H,12H2,1-4H3