2,2-dimethylpropanoyloxymethyl-(5,5-diphenylpent-2-ynyl)-diethyl-azanium

Systemtic Name: 2,2-dimethylpropanoyloxymethyl-(5,5-diphenylpent-2-ynyl)-diethyl-azanium Openeye Name: 2,2-dimethylpropanoyloxymethyl-(5,5-diphenylpent-2-ynyl)-diethyl-ammonium CAS Name: (2,2-dimethyl-1-oxopropoxy)methyl-(5,5-diphenylpent-2-ynyl)-diethylammonium IUPAC Name: 2,2-dimethylpropanoyloxymethyl-(5,5-diphenylpent-2-ynyl)-diethylazanium Traditional Name: 5,5-diphenylpent-2-ynyl-diethyl-(pivaloyloxymethyl)ammonium Formula: C27H36NO2+ MolecularWeight: 406.58024

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC#CCC(C1=CC=CC=C1)C2=CC=CC=C2)COC(=O)C(C)(C)C

Isomeric SMILES

CC[N+](CC)(CC#CCC(C1=CC=CC=C1)C2=CC=CC=C2)COC(=O)C(C)(C)C

InChI

InChI=1S/C27H36NO2/c1-6-28(7-2,22-30-26(29)27(3,4)5)21-15-14-20-25(23-16-10-8-11-17-23)24-18-12-9-13-19-24/h8-13,16-19,25H,6-7,20-22H2,1-5H3/q+1