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

Systemtic Name: methyl 4-[1-(3-imidazol-1-ylpropyl)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-2H-pyrrol-2-yl]benzoate Openeye Name: methyl 4-[4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-(7-methoxybenzofuran-2-carbonyl)-5-oxo-2H-pyrrol-2-yl]benzoate CAS Name: 4-[4-hydroxy-1-[3-(1-imidazolyl)propyl]-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-5-oxo-2H-pyrrol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-(7-methoxy-1-benzofuran-2-carbonyl)-5-oxo-2H-pyrrol-2-yl]benzoate Traditional Name: 4-[4-hydroxy-1-(3-imidazol-1-ylpropyl)-5-keto-3-(7-methoxybenzofuran-2-carbonyl)-3-pyrrolin-2-yl]benzoic acid methyl ester Formula: C28H25N3O7 MolecularWeight: 515.514

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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)CCCN5C=CN=C5)O

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC=C(C=C4)C(=O)OC)CCCN5C=CN=C5)O

InChI

InChI=1S/C28H25N3O7/c1-36-20-6-3-5-19-15-21(38-26(19)20)24(32)22-23(17-7-9-18(10-8-17)28(35)37-2)31(27(34)25(22)33)13-4-12-30-14-11-29-16-30/h3,5-11,14-16,23,33H,4,12-13H2,1-2H3