ethoxycarbonyl-methyl-[2-(methylamino)ethanoyloxymethyl]-(3-nitrophenyl)azanium

Systemtic Name: ethoxycarbonyl-methyl-[2-(methylamino)ethanoyloxymethyl]-(3-nitrophenyl)azanium Openeye Name: ethoxycarbonyl-methyl-[[2-(methylamino)acetyl]oxymethyl]-(3-nitrophenyl)ammonium CAS Name: ethoxycarbonyl-methyl-[[2-(methylamino)-1-oxoethoxy]methyl]-(3-nitrophenyl)ammonium IUPAC Name: ethoxycarbonyl-methyl-[[2-(methylamino)acetyl]oxymethyl]-(3-nitrophenyl)azanium Traditional Name: carbethoxy-methyl-(3-nitrophenyl)-(sarcosyloxymethyl)ammonium Formula: C14H20N3O6+ MolecularWeight: 326.3251

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N3O6/c1-4-22-14(19)17(3,10-23-13(18)9-15-2)12-7-5-6-11(8-12)16(20)21/h5-8,15H,4,9-10H2,1-3H3/q+1