4-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]-1-(4-methylphenyl)butan-2-ol

Systemtic Name: 4-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]-1-(4-methylphenyl)butan-2-ol Openeye Name: 4-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]-1-(p-tolyl)butan-2-ol CAS Name: 4-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methylamino]-1-(4-methylphenyl)-2-butanol IUPAC Name: 4-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methylamino]-1-(4-methylphenyl)butan-2-ol Traditional Name: 4-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amino]-1-(p-tolyl)butan-2-ol Formula: C21H31NO MolecularWeight: 313.47694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO/c1-18-9-11-19(12-10-18)17-20(23)13-16-22(5)15-8-6-7-14-21(2,3)4/h6,8-12,20,23H,13,15-17H2,1-5H3/b8-6+