(2,3,6-trimethylphenyl) 1-(furan-2-ylcarbonyl)piperidine-4-carboxylate

Systemtic Name: (2,3,6-trimethylphenyl) 1-(furan-2-ylcarbonyl)piperidine-4-carboxylate Openeye Name: (2,3,6-trimethylphenyl) 1-(furan-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[2-furanyl(oxo)methyl]-4-piperidinecarboxylic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 1-(furan-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(2-furoyl)isonipecotic acid (2,3,6-trimethylphenyl) ester Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2CCN(CC2)C(=O)C3=CC=CO3)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)C2CCN(CC2)C(=O)C3=CC=CO3)C

InChI

InChI=1S/C20H23NO4/c1-13-6-7-14(2)18(15(13)3)25-20(23)16-8-10-21(11-9-16)19(22)17-5-4-12-24-17/h4-7,12,16H,8-11H2,1-3H3