2,5-dimethyl-1-pentan-3-yl-pyrrole-3-carboxylic acid

Systemtic Name: 2,5-dimethyl-1-pentan-3-yl-pyrrole-3-carboxylic acid Openeye Name: 1-(1-ethylpropyl)-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 2,5-dimethyl-1-pentan-3-yl-3-pyrrolecarboxylic acid IUPAC Name: 2,5-dimethyl-1-pentan-3-ylpyrrole-3-carboxylic acid Traditional Name: 1-(1-ethylpropyl)-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=CC(=C1C)C(=O)O)C

Isomeric SMILES

CCC(CC)N1C(=CC(=C1C)C(=O)O)C

InChI

InChI=1S/C12H19NO2/c1-5-10(6-2)13-8(3)7-11(9(13)4)12(14)15/h7,10H,5-6H2,1-4H3,(H,14,15)