3-[1-butyl-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-butyl-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-butyl-5-(p-tolyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-butyl-5-(4-methylphenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-butyl-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-butyl-5-(p-tolyl)pyrrol-2-yl]propionic acid Formula: C18H23NO2 MolecularWeight: 285.38072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC=C1C2=CC=C(C=C2)C)CCC(=O)O

Isomeric SMILES

CCCCN1C(=CC=C1C2=CC=C(C=C2)C)CCC(=O)O

InChI

InChI=1S/C18H23NO2/c1-3-4-13-19-16(10-12-18(20)21)9-11-17(19)15-7-5-14(2)6-8-15/h5-9,11H,3-4,10,12-13H2,1-2H3,(H,20,21)