(2-azaniumyl-3-oxidanyl-3-oxidanylidene-propyl)-methyl-(phenylmethyl)azanium dichloride

Systemtic Name: (2-azaniumyl-3-oxidanyl-3-oxidanylidene-propyl)-methyl-(phenylmethyl)azanium dichloride Openeye Name: (2-azaniumyl-3-hydroxy-3-oxo-propyl)-benzyl-methyl-ammonium dichloride CAS Name: (2-ammonio-3-hydroxy-3-oxopropyl)-methyl-(phenylmethyl)ammonium dichloride IUPAC Name: (2-azaniumyl-3-hydroxy-3-oxopropyl)-benzyl-methylazanium dichloride Traditional Name: (2-ammonio-3-hydroxy-3-keto-propyl)-benzyl-methyl-ammonium dichloride Formula: C11H18Cl2N2O2 MolecularWeight: 281.17882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O2.2ClH/c1-13(8-10(12)11(14)15)7-9-5-3-2-4-6-9;;/h2-6,10H,7-8,12H2,1H3,(H,14,15);2*1H