2-butanoyloxyethyl-dimethyl-[(2-nitrophenyl)methyl]azanium iodide

Systemtic Name: 2-butanoyloxyethyl-dimethyl-[(2-nitrophenyl)methyl]azanium iodide Openeye Name: 2-butanoyloxyethyl-dimethyl-[(2-nitrophenyl)methyl]ammonium iodide CAS Name: dimethyl-[(2-nitrophenyl)methyl]-[2-(1-oxobutoxy)ethyl]ammonium iodide IUPAC Name: 2-butanoyloxyethyl-dimethyl-[(2-nitrophenyl)methyl]azanium iodide Traditional Name: 2-butyryloxyethyl-dimethyl-(2-nitrobenzyl)ammonium iodide Formula: C15H23IN2O4 MolecularWeight: 422.25859

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC[N+](C)(C)CC1=CC=CC=C1[N+](=O)[O-].[I-]

Isomeric SMILES

CCCC(=O)OCC[N+](C)(C)CC1=CC=CC=C1[N+](=O)[O-].[I-]

InChI

InChI=1S/C15H23N2O4.HI/c1-4-7-15(18)21-11-10-17(2,3)12-13-8-5-6-9-14(13)16(19)20;/h5-6,8-9H,4,7,10-12H2,1-3H3;1H/q+1;/p-1