2,5-dimethyl-1-pentyl-pyrrole-3-carboxylate

Systemtic Name: 2,5-dimethyl-1-pentyl-pyrrole-3-carboxylate Openeye Name: 2,5-dimethyl-1-pentyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-pentyl-3-pyrrolecarboxylate IUPAC Name: 2,5-dimethyl-1-pentylpyrrole-3-carboxylate Traditional Name: 1-amyl-2,5-dimethyl-pyrrole-3-carboxylate Formula: C12H18NO2- MolecularWeight: 208.27682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=CC(=C1C)C(=O)[O-])C

Isomeric SMILES

CCCCCN1C(=CC(=C1C)C(=O)[O-])C

InChI

InChI=1S/C12H19NO2/c1-4-5-6-7-13-9(2)8-11(10(13)3)12(14)15/h8H,4-7H2,1-3H3,(H,14,15)/p-1