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

Systemtic Name: (E)-6,6-dimethyl-N-[(3-phenylmethoxyphenyl)methyl]-N-propyl-hept-2-en-4-yn-1-amine Openeye Name: (E)-N-[(3-benzyloxyphenyl)methyl]-6,6-dimethyl-N-propyl-hept-2-en-4-yn-1-amine CAS Name: (E)-6,6-dimethyl-N-[(3-phenylmethoxyphenyl)methyl]-N-propyl-1-hept-2-en-4-ynamine IUPAC Name: (E)-6,6-dimethyl-N-[(3-phenylmethoxyphenyl)methyl]-N-propylhept-2-en-4-yn-1-amine Traditional Name: (3-benzoxybenzyl)-[(E)-6,6-dimethylhept-2-en-4-ynyl]-propyl-amine Formula: C26H33NO MolecularWeight: 375.54632

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC=CC#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CCCN(C/C=C/C#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C26H33NO/c1-5-18-27(19-11-7-10-17-26(2,3)4)21-24-15-12-16-25(20-24)28-22-23-13-8-6-9-14-23/h6-9,11-16,20H,5,18-19,21-22H2,1-4H3/b11-7+