2-[5-(4-chlorophenyl)carbonyl-1-(3-methylbutyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 2-[5-(4-chlorophenyl)carbonyl-1-(3-methylbutyl)pyrrol-2-yl]propanoic acid Openeye Name: 2-[5-(4-chlorobenzoyl)-1-isopentyl-pyrrol-2-yl]propanoic acid CAS Name: 2-[5-[(4-chlorophenyl)-oxomethyl]-1-(3-methylbutyl)-2-pyrrolyl]propanoic acid IUPAC Name: 2-[5-(4-chlorobenzoyl)-1-(3-methylbutyl)pyrrol-2-yl]propanoic acid Traditional Name: 2-[5-(4-chlorobenzoyl)-1-isoamyl-pyrrol-2-yl]propionic acid Formula: C19H22ClNO3 MolecularWeight: 347.83588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=CC=C1C(=O)C2=CC=C(C=C2)Cl)C(C)C(=O)O

Isomeric SMILES

CC(C)CCN1C(=CC=C1C(=O)C2=CC=C(C=C2)Cl)C(C)C(=O)O

InChI

InChI=1S/C19H22ClNO3/c1-12(2)10-11-21-16(13(3)19(23)24)8-9-17(21)18(22)14-4-6-15(20)7-5-14/h4-9,12-13H,10-11H2,1-3H3,(H,23,24)