4,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid

Systemtic Name: 4,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid Openeye Name: 4,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid CAS Name: 4,5-dimethyl-1-phenyl-3-pyrrolecarboxylic acid IUPAC Name: 4,5-dimethyl-1-phenylpyrrole-3-carboxylic acid Traditional Name: 4,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C=C1C(=O)O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(N(C=C1C(=O)O)C2=CC=CC=C2)C

InChI

InChI=1S/C13H13NO2/c1-9-10(2)14(8-12(9)13(15)16)11-6-4-3-5-7-11/h3-8H,1-2H3,(H,15,16)