1-iodanylprop-2-ynyl-dipentyl-phenethyl-azanium

Systemtic Name: 1-iodanylprop-2-ynyl-dipentyl-phenethyl-azanium Openeye Name: 1-iodoprop-2-ynyl-dipentyl-phenethyl-ammonium CAS Name: 1-iodoprop-2-ynyl-dipentyl-phenethylammonium IUPAC Name: 1-iodoprop-2-ynyl-dipentyl-phenethylazanium Traditional Name: diamyl-(1-iodoprop-2-ynyl)-phenethyl-ammonium Formula: C21H33IN+ MolecularWeight: 426.39789

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](CCCCC)(CCC1=CC=CC=C1)C(C#C)I

Isomeric SMILES

CCCCC[N+](CCCCC)(CCC1=CC=CC=C1)C(C#C)I

InChI

InChI=1S/C21H33IN/c1-4-7-12-17-23(21(22)6-3,18-13-8-5-2)19-16-20-14-10-9-11-15-20/h3,9-11,14-15,21H,4-5,7-8,12-13,16-19H2,1-2H3/q+1