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

Systemtic Name: 2,5-dimethyl-1-(2-methylbutan-2-yl)pyrrole-3-carboxylate Openeye Name: 1-(1,1-dimethylpropyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(2-methylbutan-2-yl)-3-pyrrolecarboxylate IUPAC Name: 2,5-dimethyl-1-(2-methylbutan-2-yl)pyrrole-3-carboxylate Traditional Name: 1-tert-amyl-2,5-dimethyl-pyrrole-3-carboxylate Formula: C12H18NO2- MolecularWeight: 208.27682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N1C(=CC(=C1C)C(=O)[O-])C

Isomeric SMILES

CCC(C)(C)N1C(=CC(=C1C)C(=O)[O-])C

InChI

InChI=1S/C12H19NO2/c1-6-12(4,5)13-8(2)7-10(9(13)3)11(14)15/h7H,6H2,1-5H3,(H,14,15)/p-1