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

Systemtic Name: (E)-6,6-dimethyl-N-propyl-N-[[3-[(3-pyrrol-1-ylphenyl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-6,6-dimethyl-N-propyl-N-[[3-[(3-pyrrol-1-ylphenyl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine CAS Name: (E)-6,6-dimethyl-N-propyl-N-[[3-[[3-(1-pyrrolyl)phenyl]methoxy]phenyl]methyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-6,6-dimethyl-N-propyl-N-[[3-[(3-pyrrol-1-ylphenyl)methoxy]phenyl]methyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-propyl-[3-(3-pyrrol-1-ylbenzyl)oxybenzyl]amine Formula: C30H36N2O MolecularWeight: 440.61964

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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)N3C=CC=C3

Isomeric SMILES

CCCN(C/C=C/C#CC(C)(C)C)CC1=CC(=CC=C1)OCC2=CC(=CC=C2)N3C=CC=C3

InChI

InChI=1S/C30H36N2O/c1-5-18-31(19-8-6-7-17-30(2,3)4)24-26-13-12-16-29(23-26)33-25-27-14-11-15-28(22-27)32-20-9-10-21-32/h6,8-16,20-23H,5,18-19,24-25H2,1-4H3/b8-6+