tert-butyl 2-[(4-bromophenyl)methyl]-4-methoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 2-[(4-bromophenyl)methyl]-4-methoxy-indole-1-carboxylate Openeye Name: tert-butyl 2-[(4-bromophenyl)methyl]-4-methoxy-indole-1-carboxylate CAS Name: 2-[(4-bromophenyl)methyl]-4-methoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-bromophenyl)methyl]-4-methoxyindole-1-carboxylate Traditional Name: 2-(4-bromobenzyl)-4-methoxy-indole-1-carboxylic acid tert-butyl ester Formula: C21H22BrNO3 MolecularWeight: 416.30828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C1CC3=CC=C(C=C3)Br)C(=CC=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C1CC3=CC=C(C=C3)Br)C(=CC=C2)OC

InChI

InChI=1S/C21H22BrNO3/c1-21(2,3)26-20(24)23-16(12-14-8-10-15(22)11-9-14)13-17-18(23)6-5-7-19(17)25-4/h5-11,13H,12H2,1-4H3