(1-bromanyl-3-methyl-pent-1-yn-3-yl) 2-phenyl-2-piperidin-1-yl-ethanoate hydrochloride

Systemtic Name: (1-bromanyl-3-methyl-pent-1-yn-3-yl) 2-phenyl-2-piperidin-1-yl-ethanoate hydrochloride Openeye Name: (3-bromo-1-ethyl-1-methyl-prop-2-ynyl) 2-phenyl-2-(1-piperidyl)acetate hydrochloride CAS Name: 2-phenyl-2-(1-piperidinyl)acetic acid (1-bromo-3-methylpent-1-yn-3-yl) ester hydrochloride IUPAC Name: (1-bromo-3-methylpent-1-yn-3-yl) 2-phenyl-2-piperidin-1-ylacetate hydrochloride Traditional Name: 2-phenyl-2-piperidino-acetic acid (3-bromo-1-ethyl-1-methyl-prop-2-ynyl) ester hydrochloride Formula: C19H25BrClNO2 MolecularWeight: 414.7643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#CBr)OC(=O)C(C1=CC=CC=C1)N2CCCCC2.Cl

Isomeric SMILES

CCC(C)(C#CBr)OC(=O)C(C1=CC=CC=C1)N2CCCCC2.Cl

InChI

InChI=1S/C19H24BrNO2.ClH/c1-3-19(2,12-13-20)23-18(22)17(16-10-6-4-7-11-16)21-14-8-5-9-15-21;/h4,6-7,10-11,17H,3,5,8-9,14-15H2,1-2H3;1H