2-[5-(4-methylphenyl)carbonyl-1-propyl-pyrrol-2-yl]butanoic acid

Systemtic Name: 2-[5-(4-methylphenyl)carbonyl-1-propyl-pyrrol-2-yl]butanoic acid Openeye Name: 2-[5-(4-methylbenzoyl)-1-propyl-pyrrol-2-yl]butanoic acid CAS Name: 2-[5-[(4-methylphenyl)-oxomethyl]-1-propyl-2-pyrrolyl]butanoic acid IUPAC Name: 2-[5-(4-methylbenzoyl)-1-propylpyrrol-2-yl]butanoic acid Traditional Name: 2-(1-propyl-5-p-toluoyl-pyrrol-2-yl)butyric acid Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC=C1C(=O)C2=CC=C(C=C2)C)C(CC)C(=O)O

Isomeric SMILES

CCCN1C(=CC=C1C(=O)C2=CC=C(C=C2)C)C(CC)C(=O)O

InChI

InChI=1S/C19H23NO3/c1-4-12-20-16(15(5-2)19(22)23)10-11-17(20)18(21)14-8-6-13(3)7-9-14/h6-11,15H,4-5,12H2,1-3H3,(H,22,23)