(2S)-3-(1-benzofuran-2-ylcarbonyl)-2-(3-methoxy-4-propoxy-phenyl)-1-(5-methyl-1,2-oxazol-3-yl)-5-oxidanylidene-2H-pyrrol-4-olate

Systemtic Name: (2S)-3-(1-benzofuran-2-ylcarbonyl)-2-(3-methoxy-4-propoxy-phenyl)-1-(5-methyl-1,2-oxazol-3-yl)-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: (2S)-3-(benzofuran-2-carbonyl)-2-(3-methoxy-4-propoxy-phenyl)-1-(5-methylisoxazol-3-yl)-5-oxo-2H-pyrrol-4-olate CAS Name: (2S)-3-[2-benzofuranyl(oxo)methyl]-2-(3-methoxy-4-propoxyphenyl)-1-(5-methyl-3-isoxazolyl)-5-oxo-2H-pyrrol-4-olate IUPAC Name: (2S)-3-(1-benzofuran-2-carbonyl)-2-(3-methoxy-4-propoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)-5-oxo-2H-pyrrol-4-olate Traditional Name: (5S)-4-(benzofuran-2-carbonyl)-2-keto-5-(3-methoxy-4-propoxy-phenyl)-1-(5-methylisoxazol-3-yl)-3-pyrrolin-3-olate Formula: C27H23N2O7- MolecularWeight: 487.48072

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NOC(=C3)C)[O-])C(=O)C4=CC5=CC=CC=C5O4)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H]2C(=C(C(=O)N2C3=NOC(=C3)C)[O-])C(=O)C4=CC5=CC=CC=C5O4)OC

InChI

InChI=1S/C27H24N2O7/c1-4-11-34-19-10-9-17(14-20(19)33-3)24-23(25(30)21-13-16-7-5-6-8-18(16)35-21)26(31)27(32)29(24)22-12-15(2)36-28-22/h5-10,12-14,24,31H,4,11H2,1-3H3/p-1/t24-/m0/s1