[2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 4-butoxy-3-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 4-butoxy-3-methoxy-benzoate Openeye Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 4-butoxy-3-methoxy-benzoate CAS Name: 4-butoxy-3-methoxybenzoic acid [2-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 4-butoxy-3-methoxybenzoate Traditional Name: 4-butoxy-3-methoxy-benzoic acid [2-keto-2-(2-thenoylamino)ethyl] ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC(=O)C2=CC=CS2)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC(=O)C2=CC=CS2)OC

InChI

InChI=1S/C19H21NO6S/c1-3-4-9-25-14-8-7-13(11-15(14)24-2)19(23)26-12-17(21)20-18(22)16-6-5-10-27-16/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,20,21,22)