[(2S)-4-methoxy-3,4-bis(oxidanylidene)-1-phenyl-butan-2-yl]azanium chloride

Systemtic Name: [(2S)-4-methoxy-3,4-bis(oxidanylidene)-1-phenyl-butan-2-yl]azanium chloride Openeye Name: [(1S)-1-benzyl-3-methoxy-2,3-dioxo-propyl]ammonium chloride CAS Name: [(2S)-4-methoxy-3,4-dioxo-1-phenylbutan-2-yl]ammonium chloride IUPAC Name: [(2S)-4-methoxy-3,4-dioxo-1-phenylbutan-2-yl]azanium chloride Traditional Name: [(1S)-1-benzyl-2,3-diketo-3-methoxy-propyl]ammonium chloride Formula: C11H14ClNO3 MolecularWeight: 243.68676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3.ClH/c1-15-11(14)10(13)9(12)7-8-5-3-2-4-6-8;/h2-6,9H,7,12H2,1H3;1H/t9-;/m0./s1