4-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C)C(=O)O)C

Isomeric SMILES

CCC1=C(NC(=C1C)C(=O)O)C

InChI

InChI=1S/C9H13NO2/c1-4-7-5(2)8(9(11)12)10-6(7)3/h10H,4H2,1-3H3,(H,11,12)