1-(4-pyrrolidin-1-ylbut-2-ynyl)azepan-2-one

Systemtic Name: 1-(4-pyrrolidin-1-ylbut-2-ynyl)azepan-2-one Openeye Name: 1-(4-pyrrolidin-1-ylbut-2-ynyl)azepan-2-one CAS Name: 1-[4-(1-pyrrolidinyl)but-2-ynyl]-2-azepanone IUPAC Name: 1-(4-pyrrolidin-1-ylbut-2-ynyl)azepan-2-one Traditional Name: 1-(4-pyrrolidinobut-2-ynyl)azepan-2-one Formula: C14H22N2O MolecularWeight: 234.33728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC#CCN2CCCC2

Isomeric SMILES

C1CCC(=O)N(CC1)CC#CCN2CCCC2

InChI

InChI=1S/C14H22N2O/c17-14-8-2-1-3-12-16(14)13-7-6-11-15-9-4-5-10-15/h1-5,8-13H2