[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate

Systemtic Name: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate Openeye Name: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 2-(3-oxo-1,4-benzothiazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzothiazin-4-yl)acetic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 2-(3-oxo-1,4-benzothiazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzothiazin-4-yl)acetic acid [2-(3,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)COC(=O)CN2C(=O)CSC3=CC=CC=C32)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)COC(=O)CN2C(=O)CSC3=CC=CC=C32)OC

InChI

InChI=1S/C20H20N2O6S/c1-26-15-8-7-13(9-16(15)27-2)21-18(23)11-28-20(25)10-22-14-5-3-4-6-17(14)29-12-19(22)24/h3-9H,10-12H2,1-2H3,(H,21,23)