5-tert-butyl-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid hydrochloride

Systemtic Name: 5-tert-butyl-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid hydrochloride Openeye Name: 5-tert-butyl-2-(1-piperidylmethyl)furan-3-carboxylic acid hydrochloride CAS Name: 5-tert-butyl-2-(1-piperidinylmethyl)-3-furancarboxylic acid hydrochloride IUPAC Name: 5-tert-butyl-2-(piperidin-1-ylmethyl)furan-3-carboxylic acid hydrochloride Traditional Name: 5-tert-butyl-2-(piperidinomethyl)-3-furoic acid hydrochloride Formula: C15H24ClNO3 MolecularWeight: 301.80896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(O1)CN2CCCCC2)C(=O)O.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(O1)CN2CCCCC2)C(=O)O.Cl

InChI

InChI=1S/C15H23NO3.ClH/c1-15(2,3)13-9-11(14(17)18)12(19-13)10-16-7-5-4-6-8-16;/h9H,4-8,10H2,1-3H3,(H,17,18);1H