2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-(thiophen-3-ylcarbonylamino)butanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-(thiophen-3-ylcarbonylamino)butanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 4-(thiophene-3-carbonylamino)butanoate CAS Name: 4-[[oxo(3-thiophenyl)methyl]amino]butanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 4-(thiophene-3-carbonylamino)butanoate Traditional Name: 4-(3-thenoylamino)butyric acid 2-phthalimidoethyl ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C19H18N2O5S/c22-16(6-3-8-20-17(23)13-7-11-27-12-13)26-10-9-21-18(24)14-4-1-2-5-15(14)19(21)25/h1-2,4-5,7,11-12H,3,6,8-10H2,(H,20,23)