2-[4-[4-[1-(4-bromophenyl)-5-methyl-pyrrol-2-yl]phenyl]phenoxy]-3-phenyl-propanoic acid

Systemtic Name: 2-[4-[4-[1-(4-bromophenyl)-5-methyl-pyrrol-2-yl]phenyl]phenoxy]-3-phenyl-propanoic acid Openeye Name: 2-[4-[4-[1-(4-bromophenyl)-5-methyl-pyrrol-2-yl]phenyl]phenoxy]-3-phenyl-propanoic acid CAS Name: 2-[4-[4-[1-(4-bromophenyl)-5-methyl-2-pyrrolyl]phenyl]phenoxy]-3-phenylpropanoic acid IUPAC Name: 2-[4-[4-[1-(4-bromophenyl)-5-methylpyrrol-2-yl]phenyl]phenoxy]-3-phenylpropanoic acid Traditional Name: 2-[4-[4-[1-(4-bromophenyl)-5-methyl-pyrrol-2-yl]phenyl]phenoxy]-3-phenyl-propionic acid Formula: C32H26BrNO3 MolecularWeight: 552.45774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)Br)C3=CC=C(C=C3)C4=CC=C(C=C4)OC(CC5=CC=CC=C5)C(=O)O

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)Br)C3=CC=C(C=C3)C4=CC=C(C=C4)OC(CC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C32H26BrNO3/c1-22-7-20-30(34(22)28-16-14-27(33)15-17-28)26-10-8-24(9-11-26)25-12-18-29(19-13-25)37-31(32(35)36)21-23-5-3-2-4-6-23/h2-20,31H,21H2,1H3,(H,35,36)