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

Systemtic Name: (4-methylphenyl)methyl 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate Openeye Name: p-tolylmethyl 2-(3-oxo-1,4-benzothiazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzothiazin-4-yl)acetic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 2-(3-oxo-1,4-benzothiazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzothiazin-4-yl)acetic acid (4-methylbenzyl) ester Formula: C18H17NO3S MolecularWeight: 327.39748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)CN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)CN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C18H17NO3S/c1-13-6-8-14(9-7-13)11-22-18(21)10-19-15-4-2-3-5-16(15)23-12-17(19)20/h2-9H,10-12H2,1H3