2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid 2-phthalimidoethyl ester Formula: C19H14N2O5S MolecularWeight: 382.38986

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H14N2O5S/c22-16-10-27-15-6-5-11(9-14(15)20-16)19(25)26-8-7-21-17(23)12-3-1-2-4-13(12)18(21)24/h1-6,9H,7-8,10H2,(H,20,22)