1-[3-(1-phenylprop-2-ynyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one

Systemtic Name: 1-[3-(1-phenylprop-2-ynyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one Openeye Name: 1-[3-(1-phenylprop-2-ynyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one CAS Name: 1-[3-(1-phenylprop-2-ynyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]-1-propanone IUPAC Name: 1-[3-(1-phenylprop-2-ynyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one Traditional Name: 1-[3-(1-phenylprop-2-ynyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one Formula: C18H22N2O MolecularWeight: 282.38008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C2CCC1CN(C2)C(C#C)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1C2CCC1CN(C2)C(C#C)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2O/c1-3-17(14-8-6-5-7-9-14)19-12-15-10-11-16(13-19)20(15)18(21)4-2/h1,5-9,15-17H,4,10-13H2,2H3