[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl] 4-oxidanylidene-4-(4-pentoxyphenyl)butanoate

Systemtic Name: [2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl] 4-oxidanylidene-4-(4-pentoxyphenyl)butanoate Openeye Name: [2-oxo-2-[1-(2-thienyl)ethylamino]ethyl] 4-oxo-4-(4-pentoxyphenyl)butanoate CAS Name: 4-oxo-4-(4-pentoxyphenyl)butanoic acid [2-oxo-2-(1-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-thiophen-2-ylethylamino)ethyl] 4-oxo-4-(4-pentoxyphenyl)butanoate Traditional Name: 4-(4-amoxyphenyl)-4-keto-butyric acid [2-keto-2-[1-(2-thienyl)ethylamino]ethyl] ester Formula: C23H29NO5S MolecularWeight: 431.54506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO5S/c1-3-4-5-14-28-19-10-8-18(9-11-19)20(25)12-13-23(27)29-16-22(26)24-17(2)21-7-6-15-30-21/h6-11,15,17H,3-5,12-14,16H2,1-2H3,(H,24,26)