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

Systemtic Name: 5-tert-butyl-3-(piperidin-1-ylmethyl)furan-2-carboxylic acid hydrochloride Openeye Name: 5-tert-butyl-3-(1-piperidylmethyl)furan-2-carboxylic acid hydrochloride CAS Name: 5-tert-butyl-3-(1-piperidinylmethyl)-2-furancarboxylic acid hydrochloride IUPAC Name: 5-tert-butyl-3-(piperidin-1-ylmethyl)furan-2-carboxylic acid hydrochloride Traditional Name: 5-tert-butyl-3-(piperidinomethyl)-2-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)C(=O)O)CN2CCCCC2.Cl

Isomeric SMILES

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

InChI

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