(4-nitrophenyl)methyl 2-[(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-azetidin-1-yl]-2-phenylsulfanyl-ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-[(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-azetidin-1-yl]-2-phenylsulfanyl-ethanoate Openeye Name: (4-nitrophenyl)methyl 2-[(3R)-3-(tert-butoxycarbonylamino)-2-oxo-azetidin-1-yl]-2-phenylsulfanyl-acetate CAS Name: 2-[(3R)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-1-azetidinyl]-2-(phenylthio)acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxoazetidin-1-yl]-2-phenylsulfanylacetate Traditional Name: 2-[(3R)-3-(tert-butoxycarbonylamino)-2-keto-azetidin-1-yl]-2-(phenylthio)acetic acid (4-nitrobenzyl) ester Formula: C23H25N3O7S MolecularWeight: 487.5255

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CN(C1=O)C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CN(C1=O)C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=CC=C3

InChI

InChI=1S/C23H25N3O7S/c1-23(2,3)33-22(29)24-18-13-25(19(18)27)20(34-17-7-5-4-6-8-17)21(28)32-14-15-9-11-16(12-10-15)26(30)31/h4-12,18,20H,13-14H2,1-3H3,(H,24,29)/t18-,20?/m1/s1