3-[[3-[[6,6-dimethylhept-4-yn-2-yl(methyl)amino]methyl]phenoxy]methyl]benzaldehyde

Systemtic Name: 3-[[3-[[6,6-dimethylhept-4-yn-2-yl(methyl)amino]methyl]phenoxy]methyl]benzaldehyde Openeye Name: 3-[[3-[[methyl(1,5,5-trimethylhex-3-ynyl)amino]methyl]phenoxy]methyl]benzaldehyde CAS Name: 3-[[3-[[6,6-dimethylhept-4-yn-2-yl(methyl)amino]methyl]phenoxy]methyl]benzaldehyde IUPAC Name: 3-[[3-[[6,6-dimethylhept-4-yn-2-yl(methyl)amino]methyl]phenoxy]methyl]benzaldehyde Traditional Name: 3-[[3-[[methyl(1,5,5-trimethylhex-3-ynyl)amino]methyl]phenoxy]methyl]benzaldehyde Formula: C25H31NO2 MolecularWeight: 377.51914

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#CC(C)(C)C)N(C)CC1=CC(=CC=C1)OCC2=CC=CC(=C2)C=O

Isomeric SMILES

CC(CC#CC(C)(C)C)N(C)CC1=CC(=CC=C1)OCC2=CC=CC(=C2)C=O

InChI

InChI=1S/C25H31NO2/c1-20(9-8-14-25(2,3)4)26(5)17-21-10-7-13-24(16-21)28-19-23-12-6-11-22(15-23)18-27/h6-7,10-13,15-16,18,20H,9,17,19H2,1-5H3