1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-(2-furfuryl)-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)O

InChI

InChI=1S/C12H13NO3/c1-8-6-11(12(14)15)9(2)13(8)7-10-4-3-5-16-10/h3-6H,7H2,1-2H3,(H,14,15)