(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: (3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: (3-ethoxycarbonyl-4-methyl-2-quinolyl)methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid (3-ethoxycarbonyl-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-ethoxycarbonyl-4-methylquinolin-2-yl)methyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid (3-carbethoxy-4-methyl-2-quinolyl)methyl ester Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=CC4=C(C=C3)SCC(=O)N4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=CC4=C(C=C3)SCC(=O)N4)C

InChI

InChI=1S/C23H20N2O5S/c1-3-29-23(28)21-13(2)15-6-4-5-7-16(15)24-18(21)11-30-22(27)14-8-9-19-17(10-14)25-20(26)12-31-19/h4-10H,3,11-12H2,1-2H3,(H,25,26)