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(3R,4S,6S)-6-(hydroxymethyl)azepan-1-ium-3,4-diol chloride

(3R,4S,6S)-6-(hydroxymethyl)azepan-1-ium-3,4-diol chloride

Systemtic Name:(3R,4S,6S)-6-(hydroxymethyl)azepan-1-ium-3,4-diol chloride
Openeye Name:(3R,4S,6S)-6-(hydroxymethyl)azepan-1-ium-3,4-diol chloride
CAS Name:(3R,4S,6S)-6-(hydroxymethyl)azepan-1-ium-3,4-diol chloride
IUPAC Name:(3R,4S,6S)-6-(hydroxymethyl)azepan-1-ium-3,4-diol chloride
Traditional Name:(3R,4S,6S)-6-methylolazepan-1-ium-3,4-diol chloride
Formula: C7H16ClNO3
MolecularWeight: 197.65984
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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH2+]CC(C1O)O)CO.[Cl-]


Isomeric SMILES

C1[C@@H](C[NH2+]C[C@H]([C@H]1O)O)CO.[Cl-]


InChI

InChI=1S/C7H15NO3.ClH/c9-4-5-1-6(10)7(11)3-8-2-5;/h5-11H,1-4H2;1H/t5-,6-,7+;/m0./s1


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