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

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 3-methoxy-4-phenylmethoxy-benzoate Openeye Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 4-benzyloxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-phenylmethoxybenzoic acid [2-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 3-methoxy-4-phenylmethoxybenzoate Traditional Name: 4-benzoxy-3-methoxy-benzoic acid [2-keto-2-(2-thenoylamino)ethyl] ester Formula: C22H19NO6S MolecularWeight: 425.45436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC(=O)NC(=O)C2=CC=CS2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC(=O)NC(=O)C2=CC=CS2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H19NO6S/c1-27-18-12-16(9-10-17(18)28-13-15-6-3-2-4-7-15)22(26)29-14-20(24)23-21(25)19-8-5-11-30-19/h2-12H,13-14H2,1H3,(H,23,24,25)