3-[1-[2-(4-methylphenoxy)ethyl]-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-[2-(4-methylphenoxy)ethyl]-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-[2-(4-methylphenoxy)ethyl]-5-(2-thienyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-[2-(4-methylphenoxy)ethyl]-5-thiophen-2-yl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-[2-(4-methylphenoxy)ethyl]-5-thiophen-2-ylpyrrol-2-yl]propanoic acid Traditional Name: 3-[1-[2-(4-methylphenoxy)ethyl]-5-(2-thienyl)pyrrol-2-yl]propionic acid Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=CS3)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=CS3)CCC(=O)O

InChI

InChI=1S/C20H21NO3S/c1-15-4-8-17(9-5-15)24-13-12-21-16(7-11-20(22)23)6-10-18(21)19-3-2-14-25-19/h2-6,8-10,14H,7,11-13H2,1H3,(H,22,23)