4-[[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]methyl]benzoic acid Openeye Name: 4-[[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]methyl]benzoic acid CAS Name: 4-[[2-(4-bromophenyl)-5-methyl-1-pyrrolyl]methyl]benzoic acid IUPAC Name: 4-[[2-(4-bromophenyl)-5-methylpyrrol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]methyl]benzoic acid Formula: C19H16BrNO2 MolecularWeight: 370.23984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1CC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(N1CC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H16BrNO2/c1-13-2-11-18(15-7-9-17(20)10-8-15)21(13)12-14-3-5-16(6-4-14)19(22)23/h2-11H,12H2,1H3,(H,22,23)