2,5-dimethyl-1-(3-methylbutan-2-yl)pyrrole-3-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C(C)C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C(C)C(C)C)C)C(=O)O

InChI

InChI=1S/C12H19NO2/c1-7(2)9(4)13-8(3)6-11(10(13)5)12(14)15/h6-7,9H,1-5H3,(H,14,15)