[2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 4-oxidanylidene-4-(4-pentoxyphenyl)butanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 4-oxidanylidene-4-(4-pentoxyphenyl)butanoate Openeye Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 4-oxo-4-(4-pentoxyphenyl)butanoate CAS Name: 4-oxo-4-(4-pentoxyphenyl)butanoic acid [2-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 4-oxo-4-(4-pentoxyphenyl)butanoate Traditional Name: 4-(4-amoxyphenyl)-4-keto-butyric acid [2-keto-2-(2-thenoylamino)ethyl] ester Formula: C22H25NO6S MolecularWeight: 431.502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)NC(=O)C2=CC=CS2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)NC(=O)C2=CC=CS2

InChI

InChI=1S/C22H25NO6S/c1-2-3-4-13-28-17-9-7-16(8-10-17)18(24)11-12-21(26)29-15-20(25)23-22(27)19-6-5-14-30-19/h5-10,14H,2-4,11-13,15H2,1H3,(H,23,25,27)