tert-butyl 4-[4-[ethanoyl(methyl)amino]but-2-ynyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[ethanoyl(methyl)amino]but-2-ynyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[acetyl(methyl)amino]but-2-ynyl]piperazine-1-carboxylate CAS Name: 4-[4-[acetyl(methyl)amino]but-2-ynyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[acetyl(methyl)amino]but-2-ynyl]piperazine-1-carboxylate Traditional Name: 4-[4-[acetyl(methyl)amino]but-2-ynyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C16H27N3O3 MolecularWeight: 309.40388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)CC#CCN1CCN(CC1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)N(C)CC#CCN1CCN(CC1)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H27N3O3/c1-14(20)17(5)8-6-7-9-18-10-12-19(13-11-18)15(21)22-16(2,3)4/h8-13H2,1-5H3