methyl-[2-(3-nitrophenyl)-2-oxidanyl-ethyl]-(4-phenylbutan-2-yl)azanium chloride

Systemtic Name: methyl-[2-(3-nitrophenyl)-2-oxidanyl-ethyl]-(4-phenylbutan-2-yl)azanium chloride Openeye Name: [2-hydroxy-2-(3-nitrophenyl)ethyl]-methyl-(1-methyl-3-phenyl-propyl)ammonium chloride CAS Name: [2-hydroxy-2-(3-nitrophenyl)ethyl]-methyl-(4-phenylbutan-2-yl)ammonium chloride IUPAC Name: [2-hydroxy-2-(3-nitrophenyl)ethyl]-methyl-(4-phenylbutan-2-yl)azanium chloride Traditional Name: [2-hydroxy-2-(3-nitrophenyl)ethyl]-methyl-(1-methyl-3-phenyl-propyl)ammonium chloride Formula: C19H25ClN2O3 MolecularWeight: 364.8664

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)[NH+](C)CC(C2=CC(=CC=C2)[N+](=O)[O-])O.[Cl-]

Isomeric SMILES

CC(CCC1=CC=CC=C1)[NH+](C)CC(C2=CC(=CC=C2)[N+](=O)[O-])O.[Cl-]

InChI

InChI=1S/C19H24N2O3.ClH/c1-15(11-12-16-7-4-3-5-8-16)20(2)14-19(22)17-9-6-10-18(13-17)21(23)24;/h3-10,13,15,19,22H,11-12,14H2,1-2H3;1H