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

Systemtic Name: 2-[4-[2-(4-bromophenyl)pyrrol-1-yl]phenoxy]-3-phenyl-propanoic acid Openeye Name: 2-[4-[2-(4-bromophenyl)pyrrol-1-yl]phenoxy]-3-phenyl-propanoic acid CAS Name: 2-[4-[2-(4-bromophenyl)-1-pyrrolyl]phenoxy]-3-phenylpropanoic acid IUPAC Name: 2-[4-[2-(4-bromophenyl)pyrrol-1-yl]phenoxy]-3-phenylpropanoic acid Traditional Name: 2-[4-[2-(4-bromophenyl)pyrrol-1-yl]phenoxy]-3-phenyl-propionic acid Formula: C25H20BrNO3 MolecularWeight: 462.3352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)OC2=CC=C(C=C2)N3C=CC=C3C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)OC2=CC=C(C=C2)N3C=CC=C3C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H20BrNO3/c26-20-10-8-19(9-11-20)23-7-4-16-27(23)21-12-14-22(15-13-21)30-24(25(28)29)17-18-5-2-1-3-6-18/h1-16,24H,17H2,(H,28,29)