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

Systemtic Name: 2-[4-[1-(4-bromophenyl)-5-phenyl-pyrrol-2-yl]phenoxy]-3-phenyl-propanoic acid Openeye Name: 2-[4-[1-(4-bromophenyl)-5-phenyl-pyrrol-2-yl]phenoxy]-3-phenyl-propanoic acid CAS Name: 2-[4-[1-(4-bromophenyl)-5-phenyl-2-pyrrolyl]phenoxy]-3-phenylpropanoic acid IUPAC Name: 2-[4-[1-(4-bromophenyl)-5-phenylpyrrol-2-yl]phenoxy]-3-phenylpropanoic acid Traditional Name: 2-[4-[1-(4-bromophenyl)-5-phenyl-pyrrol-2-yl]phenoxy]-3-phenyl-propionic acid Formula: C31H24BrNO3 MolecularWeight: 538.43116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)OC2=CC=C(C=C2)C3=CC=C(N3C4=CC=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)OC2=CC=C(C=C2)C3=CC=C(N3C4=CC=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C31H24BrNO3/c32-25-13-15-26(16-14-25)33-28(23-9-5-2-6-10-23)19-20-29(33)24-11-17-27(18-12-24)36-30(31(34)35)21-22-7-3-1-4-8-22/h1-20,30H,21H2,(H,34,35)