diethyl-bis[3-(4-methylphenyl)prop-2-ynyl]azanium iodide

Systemtic Name: diethyl-bis[3-(4-methylphenyl)prop-2-ynyl]azanium iodide Openeye Name: diethyl-bis[3-(p-tolyl)prop-2-ynyl]ammonium iodide CAS Name: diethyl-bis[3-(4-methylphenyl)prop-2-ynyl]ammonium iodide IUPAC Name: diethyl-bis[3-(4-methylphenyl)prop-2-ynyl]azanium iodide Traditional Name: diethyl-bis[3-(p-tolyl)prop-2-ynyl]ammonium iodide Formula: C24H28IN MolecularWeight: 457.39029

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC#CC1=CC=C(C=C1)C)CC#CC2=CC=C(C=C2)C.[I-]

Isomeric SMILES

CC[N+](CC)(CC#CC1=CC=C(C=C1)C)CC#CC2=CC=C(C=C2)C.[I-]

InChI

InChI=1S/C24H28N.HI/c1-5-25(6-2,19-7-9-23-15-11-21(3)12-16-23)20-8-10-24-17-13-22(4)14-18-24;/h11-18H,5-6,19-20H2,1-4H3;1H/q+1;/p-1