(4-nitrophenyl)methyl 2-oxidanyl-2-[(3S,4R)-2-oxidanylidene-4-pent-3-ynyl-3-(2-phenoxyethanoylamino)azetidin-1-yl]ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-oxidanyl-2-[(3S,4R)-2-oxidanylidene-4-pent-3-ynyl-3-(2-phenoxyethanoylamino)azetidin-1-yl]ethanoate Openeye Name: (4-nitrophenyl)methyl 2-hydroxy-2-[(3S,4R)-2-oxo-4-pent-3-ynyl-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetate CAS Name: 2-hydroxy-2-[(3S,4R)-2-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-4-pent-3-ynyl-1-azetidinyl]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-hydroxy-2-[(3S,4R)-2-oxo-4-pent-3-ynyl-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetate Traditional Name: 2-hydroxy-2-[(3S,4R)-2-keto-4-pent-3-ynyl-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetic acid (4-nitrobenzyl) ester Formula: C25H25N3O8 MolecularWeight: 495.4813

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCC1C(C(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC#CCC[C@@H]1[C@@H](C(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O8/c1-2-3-5-10-20-22(26-21(29)16-35-19-8-6-4-7-9-19)23(30)27(20)24(31)25(32)36-15-17-11-13-18(14-12-17)28(33)34/h4,6-9,11-14,20,22,24,31H,5,10,15-16H2,1H3,(H,26,29)/t20-,22+,24?/m1/s1