bis(2-chloroethyl)-[1-(dipentylazaniumyl)-4-propyl-hept-2-yn-4-yl]azanium dichloride

Systemtic Name: bis(2-chloroethyl)-[1-(dipentylazaniumyl)-4-propyl-hept-2-yn-4-yl]azanium dichloride Openeye Name: bis(2-chloroethyl)-[4-(dipentylammonio)-1,1-dipropyl-but-2-ynyl]ammonium dichloride CAS Name: bis(2-chloroethyl)-[1-(dipentylammonio)-4-propylhept-2-yn-4-yl]ammonium dichloride IUPAC Name: bis(2-chloroethyl)-[1-(dipentylazaniumyl)-4-propylhept-2-yn-4-yl]azanium dichloride Traditional Name: diamyl-[4-[bis(2-chloroethyl)ammonio]-4-propyl-hept-2-ynyl]ammonium dichloride Formula: C24H48Cl4N2 MolecularWeight: 506.46332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH+](CCCCC)CC#CC(CCC)(CCC)[NH+](CCCl)CCCl.[Cl-].[Cl-]

Isomeric SMILES

CCCCC[NH+](CCCCC)CC#CC(CCC)(CCC)[NH+](CCCl)CCCl.[Cl-].[Cl-]

InChI

InChI=1S/C24H46Cl2N2.2ClH/c1-5-9-11-19-27(20-12-10-6-2)21-13-16-24(14-7-3,15-8-4)28(22-17-25)23-18-26;;/h5-12,14-15,17-23H2,1-4H3;2*1H