[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C16H15NO5S MolecularWeight: 333.359

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)OCC(=O)NCC3=CC=CS3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)OCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C16H15NO5S/c18-15(17-9-12-2-1-7-23-12)10-22-16(19)11-3-4-13-14(8-11)21-6-5-20-13/h1-4,7-8H,5-6,9-10H2,(H,17,18)