diethyl 2-acetamido-2-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(4,4-dimethyl-1,3-benzothiazin-2-yl)methyl]malonic acid diethyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=NC(C2=CC=CC=C2S1)(C)C)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=NC(C2=CC=CC=C2S1)(C)C)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C20H26N2O5S/c1-6-26-17(24)20(21-13(3)23,18(25)27-7-2)12-16-22-19(4,5)14-10-8-9-11-15(14)28-16/h8-11H,6-7,12H2,1-5H3,(H,21,23)