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

Systemtic Name: [1-oxidanyl-1,4-bis(oxidanylidene)-4-phenyl-butan-2-yl]azanium chloride Openeye Name: (1-carboxy-3-oxo-3-phenyl-propyl)ammonium chloride CAS Name: (1-hydroxy-1,4-dioxo-4-phenylbutan-2-yl)ammonium chloride IUPAC Name: (1-hydroxy-1,4-dioxo-4-phenylbutan-2-yl)azanium chloride Traditional Name: (1-carboxy-3-keto-3-phenyl-propyl)ammonium chloride Formula: C10H12ClNO3 MolecularWeight: 229.66018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO3.ClH/c11-8(10(13)14)6-9(12)7-4-2-1-3-5-7;/h1-5,8H,6,11H2,(H,13,14);1H