1-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-methyl-2-furyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(5-methyl-2-furanyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(5-methyl-2-furyl)methyl]isonipecotic acid Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2CCC(CC2)C(=O)O

Isomeric SMILES

CC1=CC=C(O1)CN2CCC(CC2)C(=O)O

InChI

InChI=1S/C12H17NO3/c1-9-2-3-11(16-9)8-13-6-4-10(5-7-13)12(14)15/h2-3,10H,4-8H2,1H3,(H,14,15)