(3-methylphenyl) 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: (3-methylphenyl) 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: m-tolyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(4-chloro-2-keto-1,3-benzothiazol-3-yl)acetic acid m-tolyl ester Formula: C16H12ClNO3S MolecularWeight: 333.78938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)CN2C3=C(C=CC=C3Cl)SC2=O

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)CN2C3=C(C=CC=C3Cl)SC2=O

InChI

InChI=1S/C16H12ClNO3S/c1-10-4-2-5-11(8-10)21-14(19)9-18-15-12(17)6-3-7-13(15)22-16(18)20/h2-8H,9H2,1H3