ethyl 2-[(3E)-2-(3-methoxy-4-oxidanyl-phenyl)-4,5-bis(oxidanylidene)-3-[oxidanyl-(3-propoxyphenyl)methylidene]pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(3E)-2-(3-methoxy-4-oxidanyl-phenyl)-4,5-bis(oxidanylidene)-3-[oxidanyl-(3-propoxyphenyl)methylidene]pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(3E)-2-(4-hydroxy-3-methoxy-phenyl)-3-[hydroxy-(3-propoxyphenyl)methylene]-4,5-dioxo-pyrrolidin-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(3E)-2-(4-hydroxy-3-methoxyphenyl)-3-[hydroxy-(3-propoxyphenyl)methylidene]-4,5-dioxo-1-pyrrolidinyl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3E)-2-(4-hydroxy-3-methoxyphenyl)-3-[hydroxy-(3-propoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3E)-2-(4-hydroxy-3-methoxy-phenyl)-3-[hydroxy-(3-propoxyphenyl)methylene]-4,5-diketo-pyrrolidino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C28H28N2O8S MolecularWeight: 552.59552

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC(=C(C=C4)O)OC)O

Isomeric SMILES

CCCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC(=C(C=C4)O)OC)/O

InChI

InChI=1S/C28H28N2O8S/c1-5-12-38-18-9-7-8-17(13-18)23(32)21-22(16-10-11-19(31)20(14-16)36-4)30(26(34)24(21)33)28-29-15(3)25(39-28)27(35)37-6-2/h7-11,13-14,22,31-32H,5-6,12H2,1-4H3/b23-21+