2-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]methyl]-5-methyl-phenyl]propan-2-ol

Systemtic Name: 2-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]methyl]-5-methyl-phenyl]propan-2-ol Openeye Name: 2-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]methyl]-5-methyl-phenyl]propan-2-ol CAS Name: 2-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methylamino]methyl]-5-methylphenyl]-2-propanol IUPAC Name: 2-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methylamino]methyl]-5-methylphenyl]propan-2-ol Traditional Name: 2-[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]methyl]-5-methyl-phenyl]propan-2-ol Formula: C21H31NO MolecularWeight: 313.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C)(C)O)CN(C)CC=CC#CC(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C)(C)O)CN(C)C/C=C/C#CC(C)(C)C

InChI

InChI=1S/C21H31NO/c1-17-13-18(15-19(14-17)21(5,6)23)16-22(7)12-10-8-9-11-20(2,3)4/h8,10,13-15,23H,12,16H2,1-7H3/b10-8+