[(2S,5R)-6-methoxy-5-methyl-3,6-bis(oxidanylidene)-1-phenyl-hexan-2-yl]azanium chloride

Systemtic Name: [(2S,5R)-6-methoxy-5-methyl-3,6-bis(oxidanylidene)-1-phenyl-hexan-2-yl]azanium chloride Openeye Name: [(1S,4R)-1-benzyl-5-methoxy-4-methyl-2,5-dioxo-pentyl]ammonium chloride CAS Name: [(2S,5R)-6-methoxy-5-methyl-3,6-dioxo-1-phenylhexan-2-yl]ammonium chloride IUPAC Name: [(2S,5R)-6-methoxy-5-methyl-3,6-dioxo-1-phenylhexan-2-yl]azanium chloride Traditional Name: [(1S,4R)-1-benzyl-2,5-diketo-5-methoxy-4-methyl-pentyl]ammonium chloride Formula: C14H20ClNO3 MolecularWeight: 285.7665

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO3.ClH/c1-10(14(17)18-2)8-13(16)12(15)9-11-6-4-3-5-7-11;/h3-7,10,12H,8-9,15H2,1-2H3;1H/t10-,12+;/m1./s1