[6,7-bis(chloranyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-(2-chloroethyl)-ethyl-azanium chloride

Systemtic Name: [6,7-bis(chloranyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-(2-chloroethyl)-ethyl-azanium chloride Openeye Name: 2-chloroethyl-[(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-ethyl-ammonium chloride CAS Name: 2-chloroethyl-[(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-ethylammonium chloride IUPAC Name: 2-chloroethyl-[(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-ethylazanium chloride Traditional Name: 2-chloroethyl-[(6,7-dichloro-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-ethyl-ammonium chloride Formula: C13H17Cl4NO2 MolecularWeight: 361.09158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCl)CC1COC2=CC(=C(C=C2O1)Cl)Cl.[Cl-]

Isomeric SMILES

CC[NH+](CCCl)CC1COC2=CC(=C(C=C2O1)Cl)Cl.[Cl-]

InChI

InChI=1S/C13H16Cl3NO2.ClH/c1-2-17(4-3-14)7-9-8-18-12-5-10(15)11(16)6-13(12)19-9;/h5-6,9H,2-4,7-8H2,1H3;1H