trimethyl-[2-[[1-(2-nitrophenyl)-2-oxidanyl-2-oxidanylidene-ethyl]carbamoyloxy]ethyl]azanium

Systemtic Name: trimethyl-[2-[[1-(2-nitrophenyl)-2-oxidanyl-2-oxidanylidene-ethyl]carbamoyloxy]ethyl]azanium Openeye Name: 2-[[2-hydroxy-1-(2-nitrophenyl)-2-oxo-ethyl]carbamoyloxy]ethyl-trimethyl-ammonium CAS Name: 2-[[[2-hydroxy-1-(2-nitrophenyl)-2-oxoethyl]amino]-oxomethoxy]ethyl-trimethylammonium IUPAC Name: 2-[[2-hydroxy-1-(2-nitrophenyl)-2-oxoethyl]carbamoyloxy]ethyl-trimethylazanium Traditional Name: 2-[[2-hydroxy-2-keto-1-(2-nitrophenyl)ethyl]carbamoyloxy]ethyl-trimethyl-ammonium Formula: C14H20N3O6+ MolecularWeight: 326.3251

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC(=O)NC(C1=CC=CC=C1[N+](=O)[O-])C(=O)O

Isomeric SMILES

C[N+](C)(C)CCOC(=O)NC(C1=CC=CC=C1[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H19N3O6/c1-17(2,3)8-9-23-14(20)15-12(13(18)19)10-6-4-5-7-11(10)16(21)22/h4-7,12H,8-9H2,1-3H3,(H-,15,18,19,20)/p+1