(E)-N-[(2-bromanyl-5-phenylmethoxy-phenyl)methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N-[(2-bromanyl-5-phenylmethoxy-phenyl)methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine Openeye Name: (E)-N-[(5-benzyloxy-2-bromo-phenyl)methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine CAS Name: (E)-N-[(2-bromo-5-phenylmethoxyphenyl)methyl]-N,6,6-trimethyl-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-[(2-bromo-5-phenylmethoxyphenyl)methyl]-N,6,6-trimethylhept-2-en-4-yn-1-amine Traditional Name: (5-benzoxy-2-bromo-benzyl)-[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amine Formula: C24H28BrNO MolecularWeight: 426.38922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCN(C)CC1=C(C=CC(=C1)OCC2=CC=CC=C2)Br

Isomeric SMILES

CC(C)(C)C#C/C=C/CN(C)CC1=C(C=CC(=C1)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C24H28BrNO/c1-24(2,3)15-9-6-10-16-26(4)18-21-17-22(13-14-23(21)25)27-19-20-11-7-5-8-12-20/h5-8,10-14,17H,16,18-19H2,1-4H3/b10-6+