[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-ethoxy-4-(2-phenoxyethoxy)benzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-ethoxy-4-(2-phenoxyethoxy)benzoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3-ethoxy-4-(2-phenoxyethoxy)benzoate CAS Name: 3-ethoxy-4-(2-phenoxyethoxy)benzoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-ethoxy-4-(2-phenoxyethoxy)benzoate Traditional Name: 3-ethoxy-4-(2-phenoxyethoxy)benzoic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C24H25NO6S MolecularWeight: 455.5234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NCC2=CC=CS2)OCCOC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC(=O)NCC2=CC=CS2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C24H25NO6S/c1-2-28-22-15-18(24(27)31-17-23(26)25-16-20-9-6-14-32-20)10-11-21(22)30-13-12-29-19-7-4-3-5-8-19/h3-11,14-15H,2,12-13,16-17H2,1H3,(H,25,26)