(2-azanyl-2-oxidanylidene-ethyl) 4,5-dimethoxy-2-(2-thiophen-2-ylethanoylamino)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4,5-dimethoxy-2-(2-thiophen-2-ylethanoylamino)benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4,5-dimethoxy-2-[[2-(2-thienyl)acetyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[(1-oxo-2-thiophen-2-ylethyl)amino]benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4,5-dimethoxy-2-[(2-thiophen-2-ylacetyl)amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[2-(2-thienyl)acetyl]amino]benzoic acid (2-amino-2-keto-ethyl) ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)N)NC(=O)CC2=CC=CS2)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)N)NC(=O)CC2=CC=CS2)OC

InChI

InChI=1S/C17H18N2O6S/c1-23-13-7-11(17(22)25-9-15(18)20)12(8-14(13)24-2)19-16(21)6-10-4-3-5-26-10/h3-5,7-8H,6,9H2,1-2H3,(H2,18,20)(H,19,21)