(4-nitrophenyl)methyl 2-chloranyl-2-(2-ethylsulfanyl-4-oxidanylidene-azetidin-1-yl)ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-chloranyl-2-(2-ethylsulfanyl-4-oxidanylidene-azetidin-1-yl)ethanoate Openeye Name: (4-nitrophenyl)methyl 2-chloro-2-(2-ethylsulfanyl-4-oxo-azetidin-1-yl)acetate CAS Name: 2-chloro-2-[2-(ethylthio)-4-oxo-1-azetidinyl]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-chloro-2-(2-ethylsulfanyl-4-oxoazetidin-1-yl)acetate Traditional Name: 2-chloro-2-[2-(ethylthio)-4-keto-azetidin-1-yl]acetic acid (4-nitrobenzyl) ester Formula: C14H15ClN2O5S MolecularWeight: 358.7973

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1CC(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCSC1CC(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H15ClN2O5S/c1-2-23-12-7-11(18)16(12)13(15)14(19)22-8-9-3-5-10(6-4-9)17(20)21/h3-6,12-13H,2,7-8H2,1H3