N,N-bis(2-chloroethyl)-1-methyl-pyridin-1-ium-4-amine

Systemtic Name: N,N-bis(2-chloroethyl)-1-methyl-pyridin-1-ium-4-amine Openeye Name: N,N-bis(2-chloroethyl)-1-methyl-pyridin-1-ium-4-amine CAS Name: N,N-bis(2-chloroethyl)-1-methyl-4-pyridin-1-iumamine IUPAC Name: N,N-bis(2-chloroethyl)-1-methylpyridin-1-ium-4-amine Traditional Name: bis(2-chloroethyl)-(1-methylpyridin-1-ium-4-yl)amine Formula: C10H15Cl2N2+ MolecularWeight: 234.1455

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)N(CCCl)CCCl

Isomeric SMILES

C[N+]1=CC=C(C=C1)N(CCCl)CCCl

InChI

InChI=1S/C10H15Cl2N2/c1-13-6-2-10(3-7-13)14(8-4-11)9-5-12/h2-3,6-7H,4-5,8-9H2,1H3/q+1