3-[1-(2-methylpropyl)-5-phenyl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(2-methylpropyl)-5-phenyl-pyrrol-2-yl]propanoic acid Openeye Name: 3-(1-isobutyl-5-phenyl-pyrrol-2-yl)propanoic acid CAS Name: 3-[1-(2-methylpropyl)-5-phenyl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(2-methylpropyl)-5-phenylpyrrol-2-yl]propanoic acid Traditional Name: 3-(1-isobutyl-5-phenyl-pyrrol-2-yl)propionic acid Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CC=C1C2=CC=CC=C2)CCC(=O)O

Isomeric SMILES

CC(C)CN1C(=CC=C1C2=CC=CC=C2)CCC(=O)O

InChI

InChI=1S/C17H21NO2/c1-13(2)12-18-15(9-11-17(19)20)8-10-16(18)14-6-4-3-5-7-14/h3-8,10,13H,9,11-12H2,1-2H3,(H,19,20)