(Z)-1-[(4-nitrophenyl)methoxy]-3-oxidanylidene-2-[2-oxidanylidene-4-(triethylazaniumyl)azetidin-1-yl]-5-phenylsulfanyl-pent-1-en-1-olate

Systemtic Name: (Z)-1-[(4-nitrophenyl)methoxy]-3-oxidanylidene-2-[2-oxidanylidene-4-(triethylazaniumyl)azetidin-1-yl]-5-phenylsulfanyl-pent-1-en-1-olate Openeye Name: (Z)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(triethylammonio)azetidin-1-yl]-5-phenylsulfanyl-pent-1-en-1-olate CAS Name: (Z)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(triethylammonio)-1-azetidinyl]-5-(phenylthio)-1-penten-1-olate IUPAC Name: (Z)-1-[(4-nitrophenyl)methoxy]-3-oxo-2-[2-oxo-4-(triethylazaniumyl)azetidin-1-yl]-5-phenylsulfanylpent-1-en-1-olate Traditional Name: (Z)-3-keto-2-[2-keto-4-(triethylammonio)azetidin-1-yl]-1-(4-nitrobenzyl)oxy-5-(phenylthio)pent-1-en-1-olate Formula: C27H33N3O6S MolecularWeight: 527.63242

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)C1CC(=O)N1C(=C([O-])OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCSC3=CC=CC=C3

Isomeric SMILES

CC[N+](CC)(CC)C1CC(=O)N1/C(=C(/[O-])\OCC2=CC=C(C=C2)[N+](=O)[O-])/C(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C27H33N3O6S/c1-4-30(5-2,6-3)24-18-25(32)28(24)26(23(31)16-17-37-22-10-8-7-9-11-22)27(33)36-19-20-12-14-21(15-13-20)29(34)35/h7-15,24H,4-6,16-19H2,1-3H3