(2S)-3-(furan-2-ylcarbonyl)-1-(2-hydroxyethyl)-2-(3-methoxy-4-oxidanyl-phenyl)-5-oxidanylidene-2H-pyrrol-4-olate

Systemtic Name: (2S)-3-(furan-2-ylcarbonyl)-1-(2-hydroxyethyl)-2-(3-methoxy-4-oxidanyl-phenyl)-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: (2S)-3-(furan-2-carbonyl)-1-(2-hydroxyethyl)-2-(4-hydroxy-3-methoxy-phenyl)-5-oxo-2H-pyrrol-4-olate CAS Name: (2S)-3-[2-furanyl(oxo)methyl]-1-(2-hydroxyethyl)-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-2H-pyrrol-4-olate IUPAC Name: (2S)-3-(furan-2-carbonyl)-1-(2-hydroxyethyl)-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-2H-pyrrol-4-olate Traditional Name: (5S)-4-(2-furoyl)-1-(2-hydroxyethyl)-5-(4-hydroxy-3-methoxy-phenyl)-2-keto-3-pyrrolin-3-olate Formula: C18H16NO7- MolecularWeight: 358.32214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(=C(C(=O)N2CCO)[O-])C(=O)C3=CC=CO3)O

Isomeric SMILES

COC1=C(C=CC(=C1)[C@H]2C(=C(C(=O)N2CCO)[O-])C(=O)C3=CC=CO3)O

InChI

InChI=1S/C18H17NO7/c1-25-13-9-10(4-5-11(13)21)15-14(16(22)12-3-2-8-26-12)17(23)18(24)19(15)6-7-20/h2-5,8-9,15,20-21,23H,6-7H2,1H3/p-1/t15-/m0/s1