3-[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]-4-chloranyl-benzoic acid

Systemtic Name: 3-[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]-4-chloranyl-benzoic acid Openeye Name: 3-[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]-4-chloro-benzoic acid CAS Name: 3-[2-(4-bromophenyl)-5-methyl-1-pyrrolyl]-4-chlorobenzoic acid IUPAC Name: 3-[2-(4-bromophenyl)-5-methylpyrrol-1-yl]-4-chlorobenzoic acid Traditional Name: 3-[2-(4-bromophenyl)-5-methyl-pyrrol-1-yl]-4-chloro-benzoic acid Formula: C18H13BrClNO2 MolecularWeight: 390.65832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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