[2-oxidanylidene-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 2,6-dimethoxybenzoate

Systemtic Name: [2-oxidanylidene-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 2,6-dimethoxybenzoate Openeye Name: [2-oxo-2-[[phenyl(2-thienyl)methyl]amino]ethyl] 2,6-dimethoxybenzoate CAS Name: 2,6-dimethoxybenzoic acid [2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 2,6-dimethoxybenzoate Traditional Name: 2,6-dimethoxybenzoic acid [2-keto-2-[[phenyl(2-thienyl)methyl]amino]ethyl] ester Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)OCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)OCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C22H21NO5S/c1-26-16-10-6-11-17(27-2)20(16)22(25)28-14-19(24)23-21(18-12-7-13-29-18)15-8-4-3-5-9-15/h3-13,21H,14H2,1-2H3,(H,23,24)