3-methylbutyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: 3-methylbutyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: isopentyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid isoamyl ester Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC2=C(C=C1)SCC(=O)N2

Isomeric SMILES

CC(C)CCOC(=O)C1=CC2=C(C=C1)SCC(=O)N2

InChI

InChI=1S/C14H17NO3S/c1-9(2)5-6-18-14(17)10-3-4-12-11(7-10)15-13(16)8-19-12/h3-4,7,9H,5-6,8H2,1-2H3,(H,15,16)