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

Systemtic Name: (E)-1-[(4-nitrophenyl)methoxy]-3-oxidanylidene-2-[2-oxidanylidene-4-(trimethylazaniumyl)azetidin-1-yl]pent-1-en-1-olate Openeye Name: (E)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(trimethylammonio)azetidin-1-yl]pent-1-en-1-olate CAS Name: (E)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(trimethylammonio)-1-azetidinyl]-1-penten-1-olate IUPAC Name: (E)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(trimethylazaniumyl)azetidin-1-yl]pent-1-en-1-olate Traditional Name: (E)-3-keto-2-[2-keto-4-(trimethylammonio)azetidin-1-yl]-1-(4-nitrobenzyl)oxy-pent-1-en-1-olate Formula: C18H23N3O6 MolecularWeight: 377.39172

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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+](C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O6/c1-5-14(22)17(19-15(10-16(19)23)21(2,3)4)18(24)27-11-12-6-8-13(9-7-12)20(25)26/h6-9,15H,5,10-11H2,1-4H3