2-[2-(2-methylphenyl)carbonylpyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[2-(2-methylphenyl)carbonylpyrrol-1-yl]ethanoic acid Openeye Name: 2-[2-(2-methylbenzoyl)pyrrol-1-yl]acetic acid CAS Name: 2-[2-[(2-methylphenyl)-oxomethyl]-1-pyrrolyl]acetic acid IUPAC Name: 2-[2-(2-methylbenzoyl)pyrrol-1-yl]acetic acid Traditional Name: 2-(2-o-toluoylpyrrol-1-yl)acetic acid Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CC=CN2CC(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CC=CN2CC(=O)O

InChI

InChI=1S/C14H13NO3/c1-10-5-2-3-6-11(10)14(18)12-7-4-8-15(12)9-13(16)17/h2-8H,9H2,1H3,(H,16,17)