methyl 2-[[(2S)-1-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-5-oxidanylidene-pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[(2S)-1-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-5-oxidanylidene-pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[(2S)-1-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-5-oxo-pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[(2S)-1-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-5-oxo-2-pyrrolidinyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[(2S)-1-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-5-oxopyrrolidine-2-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[(2S)-5-keto-1-(3-keto-4,5-dimethoxy-phthalan-1-yl)prolyl]amino]-3-phenyl-propionic acid methyl ester Formula: C25H26N2O8 MolecularWeight: 482.48254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)N3C(CCC3=O)C(=O)NC(CC4=CC=CC=C4)C(=O)OC)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)N3[C@@H](CCC3=O)C(=O)NC(CC4=CC=CC=C4)C(=O)OC)OC

InChI

InChI=1S/C25H26N2O8/c1-32-18-11-9-15-20(21(18)33-2)25(31)35-23(15)27-17(10-12-19(27)28)22(29)26-16(24(30)34-3)13-14-7-5-4-6-8-14/h4-9,11,16-17,23H,10,12-13H2,1-3H3,(H,26,29)/t16?,17-,23?/m0/s1