(2-methylphenyl)methyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: (2-methylphenyl)methyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: o-tolylmethyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid (2-methylbenzyl) ester Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CC1=CC=CC=C1COC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C19H19NO3S/c1-14-6-2-3-7-15(14)12-23-19(22)10-11-20-16-8-4-5-9-17(16)24-13-18(20)21/h2-9H,10-13H2,1H3