1-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]methyl]phenyl]propan-1-one

Systemtic Name: 1-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]methyl]phenyl]propan-1-one Openeye Name: 1-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]methyl]phenyl]propan-1-one CAS Name: 1-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methylamino]methyl]phenyl]-1-propanone IUPAC Name: 1-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methylamino]methyl]phenyl]propan-1-one Traditional Name: 1-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]methyl]phenyl]propan-1-one Formula: C20H27NO MolecularWeight: 297.43448

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=CC=C1)CN(C)CC=CC#CC(C)(C)C

Isomeric SMILES

CCC(=O)C1=CC(=CC=C1)CN(C)C/C=C/C#CC(C)(C)C

InChI

InChI=1S/C20H27NO/c1-6-19(22)18-12-10-11-17(15-18)16-21(5)14-9-7-8-13-20(2,3)4/h7,9-12,15H,6,14,16H2,1-5H3/b9-7+