methyl 4-[3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-1-(pyridin-3-ylmethyl)-2H-pyrrol-2-yl]benzoate

Systemtic Name: methyl 4-[3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-1-(pyridin-3-ylmethyl)-2H-pyrrol-2-yl]benzoate Openeye Name: methyl 4-[4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-5-oxo-1-(3-pyridylmethyl)-2H-pyrrol-2-yl]benzoate CAS Name: 4-[4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-5-oxo-1-(3-pyridinylmethyl)-2H-pyrrol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-5-oxo-1-(pyridin-3-ylmethyl)-2H-pyrrol-2-yl]benzoate Traditional Name: 4-[4-hydroxy-5-keto-3-(7-methoxybenzofuran-2-carbonyl)-1-(3-pyridylmethyl)-3-pyrrolin-2-yl]benzoic acid methyl ester Formula: C28H22N2O7 MolecularWeight: 498.48348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC=C(C=C4)C(=O)OC)CC5=CN=CC=C5)O

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC=C(C=C4)C(=O)OC)CC5=CN=CC=C5)O

InChI

InChI=1S/C28H22N2O7/c1-35-20-7-3-6-19-13-21(37-26(19)20)24(31)22-23(17-8-10-18(11-9-17)28(34)36-2)30(27(33)25(22)32)15-16-5-4-12-29-14-16/h3-14,23,32H,15H2,1-2H3