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

Systemtic Name: 4-[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]-2-chloranyl-benzoic acid Openeye Name: 4-[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]-2-chloro-benzoic acid CAS Name: 4-[2-(4-bromophenyl)-5-methyl-1-pyrrolyl]-2-chlorobenzoic acid IUPAC Name: 4-[2-(4-bromophenyl)-5-methylpyrrol-1-yl]-2-chlorobenzoic acid Traditional Name: 4-[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]-2-chloro-benzoic acid Formula: C18H13BrClNO2 MolecularWeight: 390.65832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC(=C(C=C2)C(=O)O)Cl)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(N1C2=CC(=C(C=C2)C(=O)O)Cl)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H13BrClNO2/c1-11-2-9-17(12-3-5-13(19)6-4-12)21(11)14-7-8-15(18(22)23)16(20)10-14/h2-10H,1H3,(H,22,23)