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

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-methoxy-4-phenylmethoxy-benzoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 4-benzyloxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-phenylmethoxybenzoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-methoxy-4-phenylmethoxybenzoate Traditional Name: 4-benzoxy-3-methoxy-benzoic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC(=O)NCC2=CC=CS2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC(=O)NCC2=CC=CS2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21NO5S/c1-26-20-12-17(9-10-19(20)27-14-16-6-3-2-4-7-16)22(25)28-15-21(24)23-13-18-8-5-11-29-18/h2-12H,13-15H2,1H3,(H,23,24)