[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 9,10-bis(oxidanylidene)anthracene-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 9,10-bis(oxidanylidene)anthracene-1-carboxylate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 9,10-dioxoanthracene-1-carboxylate CAS Name: 9,10-dioxo-1-anthracenecarboxylic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 9,10-dioxoanthracene-1-carboxylate Traditional Name: 9,10-diketoanthracene-1-carboxylic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C22H15NO5S MolecularWeight: 405.4232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)C(=O)OCC(=O)NCC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)C(=O)OCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C22H15NO5S/c24-18(23-11-13-5-4-10-29-13)12-28-22(27)17-9-3-8-16-19(17)21(26)15-7-2-1-6-14(15)20(16)25/h1-10H,11-12H2,(H,23,24)