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

Systemtic Name: 2-[5-(4-methylphenyl)carbonyl-1-propyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[5-(4-methylbenzoyl)-1-propyl-pyrrol-2-yl]acetic acid CAS Name: 2-[5-[(4-methylphenyl)-oxomethyl]-1-propyl-2-pyrrolyl]acetic acid IUPAC Name: 2-[5-(4-methylbenzoyl)-1-propylpyrrol-2-yl]acetic acid Traditional Name: 2-(1-propyl-5-p-toluoyl-pyrrol-2-yl)acetic acid Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO3/c1-3-10-18-14(11-16(19)20)8-9-15(18)17(21)13-6-4-12(2)5-7-13/h4-9H,3,10-11H2,1-2H3,(H,19,20)