[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 9H-xanthene-9-carboxylate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 9H-xanthene-9-carboxylate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)OCC(=O)NCC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)OCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H17NO4S/c23-19(22-12-14-6-5-11-27-14)13-25-21(24)20-15-7-1-3-9-17(15)26-18-10-4-2-8-16(18)20/h1-11,20H,12-13H2,(H,22,23)