(E)-N,6,6-trimethyl-N-[[3-[[3-(1,2-oxazol-5-yl)phenyl]methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N,6,6-trimethyl-N-[[3-[[3-(1,2-oxazol-5-yl)phenyl]methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N-[[3-[(3-isoxazol-5-ylphenyl)methoxy]phenyl]methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine CAS Name: (E)-N-[[3-[[3-(5-isoxazolyl)phenyl]methoxy]phenyl]methyl]-N,6,6-trimethyl-1-hept-2-en-4-ynamine IUPAC Name: (E)-N,6,6-trimethyl-N-[[3-[[3-(1,2-oxazol-5-yl)phenyl]methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-[3-(3-isoxazol-5-ylbenzyl)oxybenzyl]-methyl-amine Formula: C27H30N2O2 MolecularWeight: 414.5393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CCN(C)CC1=CC(=CC=C1)OCC2=CC=CC(=C2)C3=CC=NO3

Isomeric SMILES

CC(C)(C)C#C/C=C/CN(C)CC1=CC(=CC=C1)OCC2=CC=CC(=C2)C3=CC=NO3

InChI

InChI=1S/C27H30N2O2/c1-27(2,3)15-6-5-7-17-29(4)20-22-10-9-13-25(19-22)30-21-23-11-8-12-24(18-23)26-14-16-28-31-26/h5,7-14,16,18-19H,17,20-21H2,1-4H3/b7-5+