(E)-N,6,6-trimethyl-N-[2-(3-phenylmethoxyphenyl)ethyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N,6,6-trimethyl-N-[2-(3-phenylmethoxyphenyl)ethyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-[2-(3-benzyloxyphenyl)ethyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine CAS Name: (E)-N,6,6-trimethyl-N-[2-(3-phenylmethoxyphenyl)ethyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N,6,6-trimethyl-N-[2-(3-phenylmethoxyphenyl)ethyl]hept-2-en-4-yn-1-amine Traditional Name: 2-(3-benzoxyphenyl)ethyl-[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amine Formula: C25H31NO MolecularWeight: 361.51974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCN(C)CCC1=CC(=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C#C/C=C/CN(C)CCC1=CC(=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C25H31NO/c1-25(2,3)17-9-6-10-18-26(4)19-16-22-14-11-15-24(20-22)27-21-23-12-7-5-8-13-23/h5-8,10-15,20H,16,18-19,21H2,1-4H3/b10-6+