(3,4-dimethylphenyl) 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: (3,4-dimethylphenyl) 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: (3,4-dimethylphenyl) 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid (3,4-dimethylphenyl) ester Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)CCN2C(=O)CSC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)CCN2C(=O)CSC3=CC=CC=C32)C

InChI

InChI=1S/C19H19NO3S/c1-13-7-8-15(11-14(13)2)23-19(22)9-10-20-16-5-3-4-6-17(16)24-12-18(20)21/h3-8,11H,9-10,12H2,1-2H3