3-[5-phenyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[5-phenyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]pyrrol-2-yl]propanoic acid Openeye Name: 3-[5-phenyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]pyrrol-2-yl]propanoic acid CAS Name: 3-[5-phenyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]-2-pyrrolyl]propanoic acid IUPAC Name: 3-[5-phenyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]pyrrol-2-yl]propanoic acid Traditional Name: 3-[5-phenyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]pyrrol-2-yl]propionic acid Formula: C24H27NO3 MolecularWeight: 377.47608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCCN2C(=CC=C2C3=CC=CC=C3)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCCN2C(=CC=C2C3=CC=CC=C3)CCC(=O)O)C

InChI

InChI=1S/C24H27NO3/c1-17-15-18(2)24(19(3)16-17)28-14-13-25-21(10-12-23(26)27)9-11-22(25)20-7-5-4-6-8-20/h4-9,11,15-16H,10,12-14H2,1-3H3,(H,26,27)