3-methyl-5-(piperidin-1-ylmethyl)furan-2-carboxylic acid

Systemtic Name: 3-methyl-5-(piperidin-1-ylmethyl)furan-2-carboxylic acid Openeye Name: 3-methyl-5-(1-piperidylmethyl)furan-2-carboxylic acid CAS Name: 3-methyl-5-(1-piperidinylmethyl)-2-furancarboxylic acid IUPAC Name: 3-methyl-5-(piperidin-1-ylmethyl)furan-2-carboxylic acid Traditional Name: 3-methyl-5-(piperidinomethyl)-2-furoic acid Formula: C12H17NO3 MolecularWeight: 223.26828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)CN2CCCCC2)C(=O)O

Isomeric SMILES

CC1=C(OC(=C1)CN2CCCCC2)C(=O)O

InChI

InChI=1S/C12H17NO3/c1-9-7-10(16-11(9)12(14)15)8-13-5-3-2-4-6-13/h7H,2-6,8H2,1H3,(H,14,15)