(3-chloranyl-4-ethoxy-phenyl)methyl-bis(2-chloroethyl)azanium

Systemtic Name: (3-chloranyl-4-ethoxy-phenyl)methyl-bis(2-chloroethyl)azanium Openeye Name: (3-chloro-4-ethoxy-phenyl)methyl-bis(2-chloroethyl)ammonium CAS Name: (3-chloro-4-ethoxyphenyl)methyl-bis(2-chloroethyl)ammonium IUPAC Name: (3-chloro-4-ethoxyphenyl)methyl-bis(2-chloroethyl)azanium Traditional Name: (3-chloro-4-ethoxy-benzyl)-bis(2-chloroethyl)ammonium Formula: C13H19Cl3NO+ MolecularWeight: 311.65506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](CCCl)CCCl)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](CCCl)CCCl)Cl

InChI

InChI=1S/C13H18Cl3NO/c1-2-18-13-4-3-11(9-12(13)16)10-17(7-5-14)8-6-15/h3-4,9H,2,5-8,10H2,1H3/p+1