[2-[2-chloranyl-4,5-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl]-methyl-azanium

Systemtic Name: [2-[2-chloranyl-4,5-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl]-methyl-azanium Openeye Name: [2-(2-chloro-4,5-dihydroxy-phenyl)-2-hydroxy-ethyl]-methyl-ammonium CAS Name: [2-(2-chloro-4,5-dihydroxyphenyl)-2-hydroxyethyl]-methylammonium IUPAC Name: [2-(2-chloro-4,5-dihydroxyphenyl)-2-hydroxyethyl]-methylazanium Traditional Name: [2-(2-chloro-4,5-dihydroxy-phenyl)-2-hydroxy-ethyl]-methyl-ammonium Formula: C9H13ClNO3+ MolecularWeight: 218.65742

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(C1=CC(=C(C=C1Cl)O)O)O

Isomeric SMILES

C[NH2+]CC(C1=CC(=C(C=C1Cl)O)O)O

InChI

InChI=1S/C9H12ClNO3/c1-11-4-9(14)5-2-7(12)8(13)3-6(5)10/h2-3,9,11-14H,4H2,1H3/p+1