(E)-1-[(4-nitrophenyl)methoxy]-3-oxidanylidene-2-[2-oxidanylidene-4-(triethylazaniumyl)azetidin-1-yl]pent-1-en-1-olate

Systemtic Name: (E)-1-[(4-nitrophenyl)methoxy]-3-oxidanylidene-2-[2-oxidanylidene-4-(triethylazaniumyl)azetidin-1-yl]pent-1-en-1-olate Openeye Name: (E)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(triethylammonio)azetidin-1-yl]pent-1-en-1-olate CAS Name: (E)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(triethylammonio)-1-azetidinyl]-1-penten-1-olate IUPAC Name: (E)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(triethylazaniumyl)azetidin-1-yl]pent-1-en-1-olate Traditional Name: (E)-3-keto-2-[2-keto-4-(triethylammonio)azetidin-1-yl]-1-(4-nitrobenzyl)oxy-pent-1-en-1-olate Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=C([O-])OCC1=CC=C(C=C1)[N+](=O)[O-])N2C(CC2=O)[N+](CC)(CC)CC

Isomeric SMILES

CCC(=O)/C(=C(/[O-])\OCC1=CC=C(C=C1)[N+](=O)[O-])/N2C(CC2=O)[N+](CC)(CC)CC

InChI

InChI=1S/C21H29N3O6/c1-5-17(25)20(22-18(13-19(22)26)24(6-2,7-3)8-4)21(27)30-14-15-9-11-16(12-10-15)23(28)29/h9-12,18H,5-8,13-14H2,1-4H3