[4-methyl-1-[(4-nitrophenyl)methoxy]-1-oxidanylidene-pentan-2-yl]azanium bromide

Systemtic Name: [4-methyl-1-[(4-nitrophenyl)methoxy]-1-oxidanylidene-pentan-2-yl]azanium bromide Openeye Name: [3-methyl-1-[(4-nitrophenyl)methoxycarbonyl]butyl]ammonium bromide CAS Name: [4-methyl-1-[(4-nitrophenyl)methoxy]-1-oxopentan-2-yl]ammonium bromide IUPAC Name: [4-methyl-1-[(4-nitrophenyl)methoxy]-1-oxopentan-2-yl]azanium bromide Traditional Name: [3-methyl-1-(4-nitrobenzyl)oxycarbonyl-butyl]ammonium bromide Formula: C13H19BrN2O4 MolecularWeight: 347.20496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])[NH3+].[Br-]

Isomeric SMILES

CC(C)CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])[NH3+].[Br-]

InChI

InChI=1S/C13H18N2O4.BrH/c1-9(2)7-12(14)13(16)19-8-10-3-5-11(6-4-10)15(17)18;/h3-6,9,12H,7-8,14H2,1-2H3;1H