(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 2-(4-ethoxyphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-ethoxyphenyl)-1,3-dioxo-5-isoindolecarboxylic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-(4-ethoxyphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-p-phenetyl-isoindoline-5-carboxylic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C25H18N2O6S MolecularWeight: 474.48522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=NOC(=C4)C5=CC=CS5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=NOC(=C4)C5=CC=CS5

InChI

InChI=1S/C25H18N2O6S/c1-2-31-18-8-6-17(7-9-18)27-23(28)19-10-5-15(12-20(19)24(27)29)25(30)32-14-16-13-21(33-26-16)22-4-3-11-34-22/h3-13H,2,14H2,1H3