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

Systemtic Name: (E)-N-[(2-methoxy-3-phenylmethoxy-phenyl)methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine Openeye Name: (E)-N-[(3-benzyloxy-2-methoxy-phenyl)methyl]-N,6,6-trimethyl-hept-2-en-4-yn-1-amine CAS Name: (E)-N-[(2-methoxy-3-phenylmethoxyphenyl)methyl]-N,6,6-trimethyl-1-hept-2-en-4-ynamine IUPAC Name: (E)-N-[(2-methoxy-3-phenylmethoxyphenyl)methyl]-N,6,6-trimethylhept-2-en-4-yn-1-amine Traditional Name: (3-benzoxy-2-methoxy-benzyl)-[(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-amine Formula: C25H31NO2 MolecularWeight: 377.51914

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H31NO2/c1-25(2,3)17-10-7-11-18-26(4)19-22-15-12-16-23(24(22)27-5)28-20-21-13-8-6-9-14-21/h6-9,11-16H,18-20H2,1-5H3/b11-7+