[3,5-bis(chloranyl)-2-ethoxy-phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [3,5-bis(chloranyl)-2-ethoxy-phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: (3,5-dichloro-2-ethoxy-phenyl)methyl-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: (3,5-dichloro-2-ethoxyphenyl)methyl-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: (3,5-dichloro-2-ethoxyphenyl)methyl-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: (3,5-dichloro-2-ethoxy-benzyl)-[(1R)-1-methylolpropyl]ammonium Formula: C13H20Cl2NO2+ MolecularWeight: 293.2094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC1=CC(=CC(=C1OCC)Cl)Cl

Isomeric SMILES

CC[C@H](CO)[NH2+]CC1=CC(=CC(=C1OCC)Cl)Cl

InChI

InChI=1S/C13H19Cl2NO2/c1-3-11(8-17)16-7-9-5-10(14)6-12(15)13(9)18-4-2/h5-6,11,16-17H,3-4,7-8H2,1-2H3/p+1/t11-/m1/s1