methyl 4-methyl-3-[2-[2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]oxyacetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[1-oxo-2-(3-oxo-4H-1,4-benzothiazin-2-yl)ethoxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]oxyacetyl]amino]benzoate Traditional Name: 3-[[2-[2-(3-keto-4H-1,4-benzothiazin-2-yl)acetyl]oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CC2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C21H20N2O6S/c1-12-7-8-13(21(27)28-2)9-15(12)22-18(24)11-29-19(25)10-17-20(26)23-14-5-3-4-6-16(14)30-17/h3-9,17H,10-11H2,1-2H3,(H,22,24)(H,23,26)