(4-nitrophenyl)methyl 2-[3-[ethanoyl(sulfanyl)amino]-2-fluoranyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: (4-nitrophenyl)methyl 2-[3-[ethanoyl(sulfanyl)amino]-2-fluoranyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: (4-nitrophenyl)methyl 2-[3-[acetyl(sulfanyl)amino]-2-fluoro-4-oxo-azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[3-[acetyl(mercapto)amino]-2-fluoro-4-oxo-1-azetidinyl]-3-methyl-3-butenoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[3-[acetyl(sulfanyl)amino]-2-fluoro-4-oxoazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[3-[acetyl(mercapto)amino]-2-fluoro-4-keto-azetidin-1-yl]-3-methyl-but-3-enoic acid (4-nitrobenzyl) ester Formula: C17H18FN3O6S MolecularWeight: 411.404723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2C(C(C2=O)N(C(=O)C)S)F

Isomeric SMILES

CC(=C)C(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2C(C(C2=O)N(C(=O)C)S)F

InChI

InChI=1S/C17H18FN3O6S/c1-9(2)13(19-15(18)14(16(19)23)20(28)10(3)22)17(24)27-8-11-4-6-12(7-5-11)21(25)26/h4-7,13-15,28H,1,8H2,2-3H3