ethyl 2-(3,4,5-trimethoxyphenyl)carbonyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylate

Systemtic Name: ethyl 2-(3,4,5-trimethoxyphenyl)carbonyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylate Openeye Name: ethyl 2-(3,4,5-trimethoxybenzoyl)-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylate CAS Name: 2-[oxo-(3,4,5-trimethoxyphenyl)methyl]-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,4,5-trimethoxybenzoyl)-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylate Traditional Name: 2-(3,4,5-trimethoxybenzoyl)-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylic acid ethyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C(N1)CCCC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC2=C(N1)CCCC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H25NO6S/c1-5-28-21(24)17-20(29-16-9-7-6-8-13(16)22-17)18(23)12-10-14(25-2)19(27-4)15(11-12)26-3/h10-11,22H,5-9H2,1-4H3