[(E)-7-methoxy-6,6-dimethyl-7-oxidanylidene-hept-2-en-4-ynyl]-methyl-(naphthalen-1-ylmethyl)azanium

Systemtic Name: [(E)-7-methoxy-6,6-dimethyl-7-oxidanylidene-hept-2-en-4-ynyl]-methyl-(naphthalen-1-ylmethyl)azanium Openeye Name: [(E)-7-methoxy-6,6-dimethyl-7-oxo-hept-2-en-4-ynyl]-methyl-(1-naphthylmethyl)ammonium CAS Name: [(E)-7-methoxy-6,6-dimethyl-7-oxohept-2-en-4-ynyl]-methyl-(1-naphthalenylmethyl)ammonium IUPAC Name: [(E)-7-methoxy-6,6-dimethyl-7-oxohept-2-en-4-ynyl]-methyl-(naphthalen-1-ylmethyl)azanium Traditional Name: [(E)-7-keto-7-methoxy-6,6-dimethyl-hept-2-en-4-ynyl]-methyl-(1-naphthylmethyl)ammonium Formula: C22H26NO2+ MolecularWeight: 336.44734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC=CC[NH+](C)CC1=CC=CC2=CC=CC=C21)C(=O)OC

Isomeric SMILES

CC(C)(C#C/C=C/C[NH+](C)CC1=CC=CC2=CC=CC=C21)C(=O)OC

InChI

InChI=1S/C22H25NO2/c1-22(2,21(24)25-4)15-8-5-9-16-23(3)17-19-13-10-12-18-11-6-7-14-20(18)19/h5-7,9-14H,16-17H2,1-4H3/p+1/b9-5+