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

Systemtic Name: [2-oxidanylidene-2-(2-phenylpropylamino)ethyl] 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: [2-oxo-2-(2-phenylpropylamino)ethyl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid [2-oxo-2-(2-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylpropylamino)ethyl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid [2-keto-2-(2-phenylpropylamino)ethyl] ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)C1=CC2=C(C=C1)SCC(=O)N2)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)COC(=O)C1=CC2=C(C=C1)SCC(=O)N2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4S/c1-13(14-5-3-2-4-6-14)10-21-18(23)11-26-20(25)15-7-8-17-16(9-15)22-19(24)12-27-17/h2-9,13H,10-12H2,1H3,(H,21,23)(H,22,24)