2,4-bis(chloranyl)-6-[[[(2R)-1-oxidanylbutan-2-yl]azaniumyl]methyl]phenolate

Systemtic Name: 2,4-bis(chloranyl)-6-[[[(2R)-1-oxidanylbutan-2-yl]azaniumyl]methyl]phenolate Openeye Name: 2,4-dichloro-6-[[[(1R)-1-(hydroxymethyl)propyl]ammonio]methyl]phenolate CAS Name: 2,4-dichloro-6-[[[(2R)-1-hydroxybutan-2-yl]ammonio]methyl]phenolate IUPAC Name: 2,4-dichloro-6-[[[(2R)-1-hydroxybutan-2-yl]azaniumyl]methyl]phenolate Traditional Name: 2,4-dichloro-6-[[[(1R)-1-methylolpropyl]ammonio]methyl]phenolate Formula: C11H15Cl2NO2 MolecularWeight: 264.1483

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC1=CC(=CC(=C1[O-])Cl)Cl

Isomeric SMILES

CC[C@H](CO)[NH2+]CC1=CC(=CC(=C1[O-])Cl)Cl

InChI

InChI=1S/C11H15Cl2NO2/c1-2-9(6-15)14-5-7-3-8(12)4-10(13)11(7)16/h3-4,9,14-16H,2,5-6H2,1H3/t9-/m1/s1