[(2R,3R)-3-methoxycarbonyl-1-phenyl-hexan-2-yl]azanium chloride

Systemtic Name: [(2R,3R)-3-methoxycarbonyl-1-phenyl-hexan-2-yl]azanium chloride Openeye Name: [(1R,2R)-1-benzyl-2-methoxycarbonyl-pentyl]ammonium chloride CAS Name: [(2R,3R)-3-methoxycarbonyl-1-phenylhexan-2-yl]ammonium chloride IUPAC Name: [(2R,3R)-3-methoxycarbonyl-1-phenylhexan-2-yl]azanium chloride Traditional Name: [(1R,2R)-1-benzyl-2-carbomethoxy-pentyl]ammonium chloride Formula: C14H22ClNO2 MolecularWeight: 271.78298

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC1=CC=CC=C1)[NH3+])C(=O)OC.[Cl-]

Isomeric SMILES

CCC[C@H]([C@@H](CC1=CC=CC=C1)[NH3+])C(=O)OC.[Cl-]

InChI

InChI=1S/C14H21NO2.ClH/c1-3-7-12(14(16)17-2)13(15)10-11-8-5-4-6-9-11;/h4-6,8-9,12-13H,3,7,10,15H2,1-2H3;1H/t12-,13-;/m1./s1