2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfonylphenyl)pyrrol-1-yl]ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfonylphenyl)pyrrol-1-yl]ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfonylphenyl)pyrrol-1-yl]ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfonylphenyl)-1-pyrrolyl]ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfonylphenyl)pyrrol-1-yl]ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-[2-(4-mesylphenyl)-5-methyl-pyrrol-1-yl]ethoxy]phenyl]propionic acid Formula: C25H29NO6S MolecularWeight: 471.56586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=C(C=C3)S(=O)(=O)C)C)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=C(C=C3)S(=O)(=O)C)C)C(=O)O

InChI

InChI=1S/C25H29NO6S/c1-4-31-24(25(27)28)17-19-6-10-21(11-7-19)32-16-15-26-18(2)5-14-23(26)20-8-12-22(13-9-20)33(3,29)30/h5-14,24H,4,15-17H2,1-3H3,(H,27,28)