[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C22H19NO4S MolecularWeight: 393.45556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CO3)CC(=O)OCC(=O)NCCC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CO3)CC(=O)OCC(=O)NCCC4=CC=CS4

InChI

InChI=1S/C22H19NO4S/c24-20(23-10-9-17-5-3-11-28-17)14-27-21(25)12-16-13-26-19-8-7-15-4-1-2-6-18(15)22(16)19/h1-8,11,13H,9-10,12,14H2,(H,23,24)