bis(2-methylpropyl)-[2-oxidanyl-3-(phenylcarbamoyloxy)propyl]azanium chloride

Systemtic Name: bis(2-methylpropyl)-[2-oxidanyl-3-(phenylcarbamoyloxy)propyl]azanium chloride Openeye Name: [2-hydroxy-3-(phenylcarbamoyloxy)propyl]-diisobutyl-ammonium chloride CAS Name: [3-[anilino(oxo)methoxy]-2-hydroxypropyl]-bis(2-methylpropyl)ammonium chloride IUPAC Name: [2-hydroxy-3-(phenylcarbamoyloxy)propyl]-bis(2-methylpropyl)azanium chloride Traditional Name: [2-hydroxy-3-(phenylcarbamoyloxy)propyl]-diisobutyl-ammonium chloride Formula: C18H31ClN2O3 MolecularWeight: 358.90334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CC(C)C)CC(COC(=O)NC1=CC=CC=C1)O.[Cl-]

Isomeric SMILES

CC(C)C[NH+](CC(C)C)CC(COC(=O)NC1=CC=CC=C1)O.[Cl-]

InChI

InChI=1S/C18H30N2O3.ClH/c1-14(2)10-20(11-15(3)4)12-17(21)13-23-18(22)19-16-8-6-5-7-9-16;/h5-9,14-15,17,21H,10-13H2,1-4H3,(H,19,22);1H