4-(2,5-dimethylphenyl)carbonyl-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-(2,5-dimethylphenyl)carbonyl-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-(2,5-dimethylbenzoyl)-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[(2,5-dimethylphenyl)-oxomethyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-(2,5-dimethylbenzoyl)-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-(2,5-dimethylbenzoyl)-1-methyl-pyrrole-2-carboxylic acid Formula: C15H15NO3 MolecularWeight: 257.2845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C2=CN(C(=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)C2=CN(C(=C2)C(=O)O)C

InChI

InChI=1S/C15H15NO3/c1-9-4-5-10(2)12(6-9)14(17)11-7-13(15(18)19)16(3)8-11/h4-8H,1-3H3,(H,18,19)