1-[(4-bromophenyl)methyl]-3-(4-methylphenyl)indole-2-carboxylic acid

Systemtic Name: 1-[(4-bromophenyl)methyl]-3-(4-methylphenyl)indole-2-carboxylic acid Openeye Name: 1-[(4-bromophenyl)methyl]-3-(p-tolyl)indole-2-carboxylic acid CAS Name: 1-[(4-bromophenyl)methyl]-3-(4-methylphenyl)-2-indolecarboxylic acid IUPAC Name: 1-[(4-bromophenyl)methyl]-3-(4-methylphenyl)indole-2-carboxylic acid Traditional Name: 1-(4-bromobenzyl)-3-(p-tolyl)indole-2-carboxylic acid Formula: C23H18BrNO2 MolecularWeight: 420.29852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(C3=CC=CC=C32)CC4=CC=C(C=C4)Br)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(C3=CC=CC=C32)CC4=CC=C(C=C4)Br)C(=O)O

InChI

InChI=1S/C23H18BrNO2/c1-15-6-10-17(11-7-15)21-19-4-2-3-5-20(19)25(22(21)23(26)27)14-16-8-12-18(24)13-9-16/h2-13H,14H2,1H3,(H,26,27)