prop-2-enyl 2-[3-(1-benzofuran-2-ylcarbonyl)-2-(4-nitrophenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: prop-2-enyl 2-[3-(1-benzofuran-2-ylcarbonyl)-2-(4-nitrophenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: allyl 2-[3-(benzofuran-2-carbonyl)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[3-(1-benzofuran-2-carbonyl)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[4-(benzofuran-2-carbonyl)-3-hydroxy-2-keto-5-(4-nitrophenyl)-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid allyl ester Formula: C27H19N3O8S MolecularWeight: 545.52006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=C(C=C5)[N+](=O)[O-])C(=O)OCC=C

Isomeric SMILES

CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=C(C=C5)[N+](=O)[O-])C(=O)OCC=C

InChI

InChI=1S/C27H19N3O8S/c1-3-12-37-26(34)24-14(2)28-27(39-24)29-21(15-8-10-17(11-9-15)30(35)36)20(23(32)25(29)33)22(31)19-13-16-6-4-5-7-18(16)38-19/h3-11,13,21,32H,1,12H2,2H3