ethyl 4-(bromomethyl)-4-[(2S)-but-3-yn-2-yl]oxy-piperidine-1-carboxylate

Systemtic Name: ethyl 4-(bromomethyl)-4-[(2S)-but-3-yn-2-yl]oxy-piperidine-1-carboxylate Openeye Name: ethyl 4-(bromomethyl)-4-[(1S)-1-methylprop-2-ynoxy]piperidine-1-carboxylate CAS Name: 4-(bromomethyl)-4-[(2S)-but-3-yn-2-yl]oxy-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(bromomethyl)-4-[(2S)-but-3-yn-2-yl]oxypiperidine-1-carboxylate Traditional Name: 4-(bromomethyl)-4-[(1S)-1-methylprop-2-ynoxy]piperidine-1-carboxylic acid ethyl ester Formula: C13H20BrNO3 MolecularWeight: 318.2068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)(CBr)OC(C)C#C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)(CBr)O[C@@H](C)C#C

InChI

InChI=1S/C13H20BrNO3/c1-4-11(3)18-13(10-14)6-8-15(9-7-13)12(16)17-5-2/h1,11H,5-10H2,2-3H3/t11-/m0/s1