(E)-6,6-dimethyl-N-[(6-phenylmethoxypyridin-2-yl)methyl]hept-2-en-4-yn-1-amine dihydrochloride

Systemtic Name: (E)-6,6-dimethyl-N-[(6-phenylmethoxypyridin-2-yl)methyl]hept-2-en-4-yn-1-amine dihydrochloride Openeye Name: (E)-N-[(6-benzyloxy-2-pyridyl)methyl]-6,6-dimethyl-hept-2-en-4-yn-1-amine dihydrochloride CAS Name: (E)-6,6-dimethyl-N-[(6-phenylmethoxy-2-pyridinyl)methyl]-1-hept-2-en-4-ynamine dihydrochloride IUPAC Name: (E)-6,6-dimethyl-N-[(6-phenylmethoxypyridin-2-yl)methyl]hept-2-en-4-yn-1-amine dihydrochloride Traditional Name: (6-benzoxy-2-pyridyl)methyl-[(E)-6,6-dimethylhept-2-en-4-ynyl]amine dihydrochloride Formula: C22H28Cl2N2O MolecularWeight: 407.37652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCNCC1=NC(=CC=C1)OCC2=CC=CC=C2.Cl.Cl

Isomeric SMILES

CC(C)(C)C#C/C=C/CNCC1=NC(=CC=C1)OCC2=CC=CC=C2.Cl.Cl

InChI

InChI=1S/C22H26N2O.2ClH/c1-22(2,3)15-8-5-9-16-23-17-20-13-10-14-21(24-20)25-18-19-11-6-4-7-12-19;;/h4-7,9-14,23H,16-18H2,1-3H3;2*1H/b9-5+;;