2-[4-[2-[2-methyl-5-(4-methylphenyl)pyrrol-1-yl]ethoxy]phenyl]-2-propoxy-propanoic acid

Systemtic Name: 2-[4-[2-[2-methyl-5-(4-methylphenyl)pyrrol-1-yl]ethoxy]phenyl]-2-propoxy-propanoic acid Openeye Name: 2-[4-[2-[2-methyl-5-(p-tolyl)pyrrol-1-yl]ethoxy]phenyl]-2-propoxy-propanoic acid CAS Name: 2-[4-[2-[2-methyl-5-(4-methylphenyl)-1-pyrrolyl]ethoxy]phenyl]-2-propoxypropanoic acid IUPAC Name: 2-[4-[2-[2-methyl-5-(4-methylphenyl)pyrrol-1-yl]ethoxy]phenyl]-2-propoxypropanoic acid Traditional Name: 2-[4-[2-[2-methyl-5-(p-tolyl)pyrrol-1-yl]ethoxy]phenyl]-2-propoxy-propionic acid Formula: C26H31NO4 MolecularWeight: 421.52864

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C)(C1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=C(C=C3)C)C)C(=O)O

Isomeric SMILES

CCCOC(C)(C1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=C(C=C3)C)C)C(=O)O

InChI

InChI=1S/C26H31NO4/c1-5-17-31-26(4,25(28)29)22-11-13-23(14-12-22)30-18-16-27-20(3)8-15-24(27)21-9-6-19(2)7-10-21/h6-15H,5,16-18H2,1-4H3,(H,28,29)