trimethyl-[3-[[1-(2-nitrophenyl)-2-oxidanyl-2-oxidanylidene-ethyl]amino]-2-oxidanyl-3-oxidanylidene-propyl]azanium

Systemtic Name: trimethyl-[3-[[1-(2-nitrophenyl)-2-oxidanyl-2-oxidanylidene-ethyl]amino]-2-oxidanyl-3-oxidanylidene-propyl]azanium Openeye Name: [2-hydroxy-3-[[2-hydroxy-1-(2-nitrophenyl)-2-oxo-ethyl]amino]-3-oxo-propyl]-trimethyl-ammonium CAS Name: [2-hydroxy-3-[[2-hydroxy-1-(2-nitrophenyl)-2-oxoethyl]amino]-3-oxopropyl]-trimethylammonium IUPAC Name: [2-hydroxy-3-[[2-hydroxy-1-(2-nitrophenyl)-2-oxoethyl]amino]-3-oxopropyl]-trimethylazanium Traditional Name: [2-hydroxy-3-[[2-hydroxy-2-keto-1-(2-nitrophenyl)ethyl]amino]-3-keto-propyl]-trimethyl-ammonium Formula: C14H20N3O6+ MolecularWeight: 326.3251

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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