1-piperidin-1-ylpropan-2-yl 2,4-bis(chloranyl)benzoate hydrochloride

Systemtic Name: 1-piperidin-1-ylpropan-2-yl 2,4-bis(chloranyl)benzoate hydrochloride Openeye Name: [1-methyl-2-(1-piperidyl)ethyl] 2,4-dichlorobenzoate hydrochloride CAS Name: 2,4-dichlorobenzoic acid 1-(1-piperidinyl)propan-2-yl ester hydrochloride IUPAC Name: 1-piperidin-1-ylpropan-2-yl 2,4-dichlorobenzoate hydrochloride Traditional Name: 2,4-dichlorobenzoic acid (1-methyl-2-piperidino-ethyl) ester hydrochloride Formula: C15H20Cl3NO2 MolecularWeight: 352.6838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCCCC1)OC(=O)C2=C(C=C(C=C2)Cl)Cl.Cl

Isomeric SMILES

CC(CN1CCCCC1)OC(=O)C2=C(C=C(C=C2)Cl)Cl.Cl

InChI

InChI=1S/C15H19Cl2NO2.ClH/c1-11(10-18-7-3-2-4-8-18)20-15(19)13-6-5-12(16)9-14(13)17;/h5-6,9,11H,2-4,7-8,10H2,1H3;1H