(4,5-dimethoxy-2-nitro-phenyl)methyl-(3-ethoxy-3-oxidanylidene-propyl)azanium

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)methyl-(3-ethoxy-3-oxidanylidene-propyl)azanium Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)methyl-(3-ethoxy-3-oxo-propyl)ammonium CAS Name: (4,5-dimethoxy-2-nitrophenyl)methyl-(3-ethoxy-3-oxopropyl)ammonium IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl-(3-ethoxy-3-oxopropyl)azanium Traditional Name: (4,5-dimethoxy-2-nitro-benzyl)-(3-ethoxy-3-keto-propyl)ammonium Formula: C14H21N2O6+ MolecularWeight: 313.32634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC[NH2+]CC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

Isomeric SMILES

CCOC(=O)CC[NH2+]CC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

InChI

InChI=1S/C14H20N2O6/c1-4-22-14(17)5-6-15-9-10-7-12(20-2)13(21-3)8-11(10)16(18)19/h7-8,15H,4-6,9H2,1-3H3/p+1