(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H16N2O5S/c23-18(26-12-13-11-16(27-21-13)17-7-4-10-28-17)8-3-9-22-19(24)14-5-1-2-6-15(14)20(22)25/h1-2,4-7,10-11H,3,8-9,12H2