[4-[bis(2-chloroethyl)amino]phenyl]-trimethyl-azanium iodide

Systemtic Name: [4-[bis(2-chloroethyl)amino]phenyl]-trimethyl-azanium iodide Openeye Name: [4-[bis(2-chloroethyl)amino]phenyl]-trimethyl-ammonium iodide CAS Name: [4-[bis(2-chloroethyl)amino]phenyl]-trimethylammonium iodide IUPAC Name: [4-[bis(2-chloroethyl)amino]phenyl]-trimethylazanium iodide Traditional Name: [4-[bis(2-chloroethyl)amino]phenyl]-trimethyl-ammonium iodide Formula: C13H21Cl2IN2 MolecularWeight: 403.12971

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)N(CCCl)CCCl.[I-]

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)N(CCCl)CCCl.[I-]

InChI

InChI=1S/C13H21Cl2N2.HI/c1-17(2,3)13-6-4-12(5-7-13)16(10-8-14)11-9-15;/h4-7H,8-11H2,1-3H3;1H/q+1;/p-1