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

Systemtic Name: 2-[4-[5-methyl-3-[1-(4-pentylphenoxy)propyl]-1H-pyrrol-2-yl]phenoxy]-3-phenyl-propanoic acid Openeye Name: 2-[4-[5-methyl-3-[1-(4-pentylphenoxy)propyl]-1H-pyrrol-2-yl]phenoxy]-3-phenyl-propanoic acid CAS Name: 2-[4-[5-methyl-3-[1-(4-pentylphenoxy)propyl]-1H-pyrrol-2-yl]phenoxy]-3-phenylpropanoic acid IUPAC Name: 2-[4-[5-methyl-3-[1-(4-pentylphenoxy)propyl]-1H-pyrrol-2-yl]phenoxy]-3-phenylpropanoic acid Traditional Name: 2-[4-[3-[1-(4-amylphenoxy)propyl]-5-methyl-1H-pyrrol-2-yl]phenoxy]-3-phenyl-propionic acid Formula: C34H39NO4 MolecularWeight: 525.67776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)OC(CC)C2=C(NC(=C2)C)C3=CC=C(C=C3)OC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)OC(CC)C2=C(NC(=C2)C)C3=CC=C(C=C3)OC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C34H39NO4/c1-4-6-8-11-25-14-18-28(19-15-25)38-31(5-2)30-22-24(3)35-33(30)27-16-20-29(21-17-27)39-32(34(36)37)23-26-12-9-7-10-13-26/h7,9-10,12-22,31-32,35H,4-6,8,11,23H2,1-3H3,(H,36,37)