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

Systemtic Name: 3-ethyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 3-ethyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 3-ethyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-ethyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 3-ethyl-4,5-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)C(=O)O

Isomeric SMILES

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

InChI

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