2,2-diethoxyethyl-dimethyl-[2-[5-(4-nitrophenyl)furan-2-yl]-2-oxidanylidene-ethyl]azanium chloride

Systemtic Name: 2,2-diethoxyethyl-dimethyl-[2-[5-(4-nitrophenyl)furan-2-yl]-2-oxidanylidene-ethyl]azanium chloride Openeye Name: 2,2-diethoxyethyl-dimethyl-[2-[5-(4-nitrophenyl)-2-furyl]-2-oxo-ethyl]ammonium chloride CAS Name: 2,2-diethoxyethyl-dimethyl-[2-[5-(4-nitrophenyl)-2-furanyl]-2-oxoethyl]ammonium chloride IUPAC Name: 2,2-diethoxyethyl-dimethyl-[2-[5-(4-nitrophenyl)furan-2-yl]-2-oxoethyl]azanium chloride Traditional Name: 2,2-diethoxyethyl-[2-keto-2-[5-(4-nitrophenyl)-2-furyl]ethyl]-dimethyl-ammonium chloride Formula: C20H27ClN2O6 MolecularWeight: 426.89118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C[N+](C)(C)CC(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])OCC.[Cl-]

Isomeric SMILES

CCOC(C[N+](C)(C)CC(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])OCC.[Cl-]

InChI

InChI=1S/C20H27N2O6.ClH/c1-5-26-20(27-6-2)14-22(3,4)13-17(23)19-12-11-18(28-19)15-7-9-16(10-8-15)21(24)25;/h7-12,20H,5-6,13-14H2,1-4H3;1H/q+1;/p-1