tert-butyl 5-bromanyl-2-(4-ethoxycarbonylphenyl)indole-1-carboxylate

Systemtic Name: tert-butyl 5-bromanyl-2-(4-ethoxycarbonylphenyl)indole-1-carboxylate Openeye Name: tert-butyl 5-bromo-2-(4-ethoxycarbonylphenyl)indole-1-carboxylate CAS Name: 5-bromo-2-(4-ethoxycarbonylphenyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-bromo-2-(4-ethoxycarbonylphenyl)indole-1-carboxylate Traditional Name: 5-bromo-2-(4-carbethoxyphenyl)indole-1-carboxylic acid tert-butyl ester Formula: C22H22BrNO4 MolecularWeight: 444.31838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC3=C(N2C(=O)OC(C)(C)C)C=CC(=C3)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC3=C(N2C(=O)OC(C)(C)C)C=CC(=C3)Br

InChI

InChI=1S/C22H22BrNO4/c1-5-27-20(25)15-8-6-14(7-9-15)19-13-16-12-17(23)10-11-18(16)24(19)21(26)28-22(2,3)4/h6-13H,5H2,1-4H3