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

Systemtic Name: (3,4-dimethylphenyl) 2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: (3,4-dimethylphenyl) 2-(2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(2-oxo-1,3-benzothiazol-3-yl)acetic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 2-(2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-keto-1,3-benzothiazol-3-yl)acetic acid (3,4-dimethylphenyl) ester Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)CN2C3=CC=CC=C3SC2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)CN2C3=CC=CC=C3SC2=O)C

InChI

InChI=1S/C17H15NO3S/c1-11-7-8-13(9-12(11)2)21-16(19)10-18-14-5-3-4-6-15(14)22-17(18)20/h3-9H,10H2,1-2H3