2-[2,3-dimethyl-4-(phenylcarbonyl)pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[2,3-dimethyl-4-(phenylcarbonyl)pyrrol-2-yl]ethanoic acid Openeye Name: 2-(4-benzoyl-2,3-dimethyl-pyrrol-2-yl)acetic acid CAS Name: 2-(4-benzoyl-2,3-dimethyl-2-pyrrolyl)acetic acid IUPAC Name: 2-(4-benzoyl-2,3-dimethylpyrrol-2-yl)acetic acid Traditional Name: 2-(4-benzoyl-2,3-dimethyl-pyrrol-2-yl)acetic acid Formula: C15H15NO3 MolecularWeight: 257.2845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NC1(C)CC(=O)O)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C=NC1(C)CC(=O)O)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H15NO3/c1-10-12(9-16-15(10,2)8-13(17)18)14(19)11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3,(H,17,18)