3-[1-(4-propan-2-ylphenyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(4-propan-2-ylphenyl)-5-thiophen-2-yl-pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(4-isopropylphenyl)-5-(2-thienyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(4-propan-2-ylphenyl)-5-thiophen-2-yl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpyrrol-2-yl]propanoic acid Traditional Name: 3-[1-p-cumenyl-5-(2-thienyl)pyrrol-2-yl]propionic acid Formula: C20H21NO2S MolecularWeight: 339.45124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=CS3)CCC(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=CC=C2C3=CC=CS3)CCC(=O)O

InChI

InChI=1S/C20H21NO2S/c1-14(2)15-5-7-16(8-6-15)21-17(10-12-20(22)23)9-11-18(21)19-4-3-13-24-19/h3-9,11,13-14H,10,12H2,1-2H3,(H,22,23)