[1,5-bis(chloranyl)-3-methyl-pentan-3-yl]-(phenylmethyl)azanium

Systemtic Name: [1,5-bis(chloranyl)-3-methyl-pentan-3-yl]-(phenylmethyl)azanium Openeye Name: benzyl-[3-chloro-1-(2-chloroethyl)-1-methyl-propyl]ammonium CAS Name: (1,5-dichloro-3-methylpentan-3-yl)-(phenylmethyl)ammonium IUPAC Name: benzyl-(1,5-dichloro-3-methylpentan-3-yl)azanium Traditional Name: benzyl-[3-chloro-1-(2-chloroethyl)-1-methyl-propyl]ammonium Formula: C13H20Cl2N+ MolecularWeight: 261.2106

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCl)(CCCl)[NH2+]CC1=CC=CC=C1

Isomeric SMILES

CC(CCCl)(CCCl)[NH2+]CC1=CC=CC=C1

InChI

InChI=1S/C13H19Cl2N/c1-13(7-9-14,8-10-15)16-11-12-5-3-2-4-6-12/h2-6,16H,7-11H2,1H3/p+1