(E)-6,6-dimethyl-N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]-N-propyl-hept-2-en-4-yn-1-amine

Systemtic Name: (E)-6,6-dimethyl-N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]-N-propyl-hept-2-en-4-yn-1-amine Openeye Name: (E)-6,6-dimethyl-N-[[3-(o-tolylmethoxy)phenyl]methyl]-N-propyl-hept-2-en-4-yn-1-amine CAS Name: (E)-6,6-dimethyl-N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]-N-propyl-1-hept-2-en-4-ynamine IUPAC Name: (E)-6,6-dimethyl-N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]-N-propylhept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-[3-(2-methylbenzyl)oxybenzyl]-propyl-amine Formula: C27H35NO MolecularWeight: 389.5729

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC=CC#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC=CC=C2C

Isomeric SMILES

CCCN(C/C=C/C#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC=CC=C2C

InChI

InChI=1S/C27H35NO/c1-6-18-28(19-11-7-10-17-27(3,4)5)21-24-14-12-16-26(20-24)29-22-25-15-9-8-13-23(25)2/h7-9,11-16,20H,6,18-19,21-22H2,1-5H3/b11-7+