(5-chloranyl-2-ethoxy-phenyl)methyl-[3-(methylazaniumyl)propyl]azanium

Systemtic Name: (5-chloranyl-2-ethoxy-phenyl)methyl-[3-(methylazaniumyl)propyl]azanium Openeye Name: (5-chloro-2-ethoxy-phenyl)methyl-[3-(methylammonio)propyl]ammonium CAS Name: (5-chloro-2-ethoxyphenyl)methyl-[3-(methylammonio)propyl]ammonium IUPAC Name: (5-chloro-2-ethoxyphenyl)methyl-[3-(methylazaniumyl)propyl]azanium Traditional Name: (5-chloro-2-ethoxy-benzyl)-[3-(methylammonio)propyl]ammonium Formula: C13H23ClN2O+2 MolecularWeight: 258.78752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C[NH2+]CCC[NH2+]C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C[NH2+]CCC[NH2+]C

InChI

InChI=1S/C13H21ClN2O/c1-3-17-13-6-5-12(14)9-11(13)10-16-8-4-7-15-2/h5-6,9,15-16H,3-4,7-8,10H2,1-2H3/p+2