(5-chloranyl-2-methoxy-phenyl)methyl-[2-(2-hydroxyethylazaniumyl)ethyl]azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-[2-(2-hydroxyethylazaniumyl)ethyl]azanium Openeye Name: (5-chloro-2-methoxy-phenyl)methyl-[2-(2-hydroxyethylammonio)ethyl]ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-[2-(2-hydroxyethylammonio)ethyl]ammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-[2-(2-hydroxyethylazaniumyl)ethyl]azanium Traditional Name: (5-chloro-2-methoxy-benzyl)-[2-(2-hydroxyethylammonio)ethyl]ammonium Formula: C12H21ClN2O2+2 MolecularWeight: 260.76034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C[NH2+]CC[NH2+]CCO

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C[NH2+]CC[NH2+]CCO

InChI

InChI=1S/C12H19ClN2O2/c1-17-12-3-2-11(13)8-10(12)9-15-5-4-14-6-7-16/h2-3,8,14-16H,4-7,9H2,1H3/p+2