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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN2CCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CN2CCCCC2)C(=O)O

InChI

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