(3-methylphenyl) 4-(1,3-benzothiazol-2-yl)benzoate

Systemtic Name: (3-methylphenyl) 4-(1,3-benzothiazol-2-yl)benzoate Openeye Name: m-tolyl 4-(1,3-benzothiazol-2-yl)benzoate CAS Name: 4-(1,3-benzothiazol-2-yl)benzoic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 4-(1,3-benzothiazol-2-yl)benzoate Traditional Name: 4-(1,3-benzothiazol-2-yl)benzoic acid m-tolyl ester Formula: C21H15NO2S MolecularWeight: 345.4143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H15NO2S/c1-14-5-4-6-17(13-14)24-21(23)16-11-9-15(10-12-16)20-22-18-7-2-3-8-19(18)25-20/h2-13H,1H3