(4-nitrophenyl)methyl 2-(3-ethyl-2-oxidanylidene-4-prop-2-enylsulfanyl-azetidin-1-yl)ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(3-ethyl-2-oxidanylidene-4-prop-2-enylsulfanyl-azetidin-1-yl)ethanoate Openeye Name: (4-nitrophenyl)methyl 2-(2-allylsulfanyl-3-ethyl-4-oxo-azetidin-1-yl)acetate CAS Name: 2-[3-ethyl-2-oxo-4-(prop-2-enylthio)-1-azetidinyl]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(3-ethyl-2-oxo-4-prop-2-enylsulfanylazetidin-1-yl)acetate Traditional Name: 2-[2-(allylthio)-3-ethyl-4-keto-azetidin-1-yl]acetic acid (4-nitrobenzyl) ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(N(C1=O)CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SCC=C

Isomeric SMILES

CCC1C(N(C1=O)CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SCC=C

InChI

InChI=1S/C17H20N2O5S/c1-3-9-25-17-14(4-2)16(21)18(17)10-15(20)24-11-12-5-7-13(8-6-12)19(22)23/h3,5-8,14,17H,1,4,9-11H2,2H3