3-phenylprop-2-ynyl(2,4,4-trimethylpentan-2-yl)azanium

Systemtic Name: 3-phenylprop-2-ynyl(2,4,4-trimethylpentan-2-yl)azanium Openeye Name: 3-phenylprop-2-ynyl(1,1,3,3-tetramethylbutyl)ammonium CAS Name: 3-phenylprop-2-ynyl(2,4,4-trimethylpentan-2-yl)ammonium IUPAC Name: 3-phenylprop-2-ynyl(2,4,4-trimethylpentan-2-yl)azanium Traditional Name: 3-phenylprop-2-ynyl(1,1,3,3-tetramethylbutyl)ammonium Formula: C17H26N+ MolecularWeight: 244.39504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)[NH2+]CC#CC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)CC(C)(C)[NH2+]CC#CC1=CC=CC=C1

InChI

InChI=1S/C17H25N/c1-16(2,3)14-17(4,5)18-13-9-12-15-10-7-6-8-11-15/h6-8,10-11,18H,13-14H2,1-5H3/p+1