ethyl 2-[(3E)-2-(3,4-dimethoxyphenyl)-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-(3,4-dimethoxyphenyl)-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-(3,4-dimethoxyphenyl)-3-[hydroxy-(3-propoxyphenyl)methylene]-4,5-dioxo-pyrrolidin-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy-(3-propoxyphenyl)methylidene]-4,5-dioxo-1-pyrrolidinyl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy-(3-propoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy-(3-propoxyphenyl)methylene]-4,5-diketo-pyrrolidino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C29H30N2O8S MolecularWeight: 566.6221

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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)OC)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)OC)OC)/O

InChI

InChI=1S/C29H30N2O8S/c1-6-13-39-19-10-8-9-18(14-19)24(32)22-23(17-11-12-20(36-4)21(15-17)37-5)31(27(34)25(22)33)29-30-16(3)26(40-29)28(35)38-7-2/h8-12,14-15,23,32H,6-7,13H2,1-5H3/b24-22+