(3-oxidanylidene-1H-2-benzofuran-1-yl) 2-[(3R,4R)-2-oxidanylidene-3-(2-phenoxyethanoylamino)-4-(phenylmethyl)sulfonyl-azetidin-1-yl]ethanoate

Systemtic Name: (3-oxidanylidene-1H-2-benzofuran-1-yl) 2-[(3R,4R)-2-oxidanylidene-3-(2-phenoxyethanoylamino)-4-(phenylmethyl)sulfonyl-azetidin-1-yl]ethanoate Openeye Name: (3-oxo-1H-isobenzofuran-1-yl) 2-[(2R,3R)-2-benzylsulfonyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetate CAS Name: 2-[(3R,4R)-2-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-4-(phenylmethyl)sulfonyl-1-azetidinyl]acetic acid (3-oxo-1H-isobenzofuran-1-yl) ester IUPAC Name: (3-oxo-1H-2-benzofuran-1-yl) 2-[(2R,3R)-2-benzylsulfonyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetate Traditional Name: 2-[(2R,3R)-2-benzylsulfonyl-4-keto-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetic acid phthalidyl ester Formula: C28H24N2O9S MolecularWeight: 564.56316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2C(C(=O)N2CC(=O)OC3C4=CC=CC=C4C(=O)O3)NC(=O)COC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)[C@@H]2[C@@H](C(=O)N2CC(=O)OC3C4=CC=CC=C4C(=O)O3)NC(=O)COC5=CC=CC=C5

InChI

InChI=1S/C28H24N2O9S/c31-22(16-37-19-11-5-2-6-12-19)29-24-25(33)30(26(24)40(35,36)17-18-9-3-1-4-10-18)15-23(32)38-28-21-14-8-7-13-20(21)27(34)39-28/h1-14,24,26,28H,15-17H2,(H,29,31)/t24-,26-,28?/m1/s1