1,3-benzothiazol-2-ylmethyl 3-methylbenzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-methylbenzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-methylbenzoate CAS Name: 3-methylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-methylbenzoate Traditional Name: 3-methylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C16H13NO2S MolecularWeight: 283.34492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13NO2S/c1-11-5-4-6-12(9-11)16(18)19-10-15-17-13-7-2-3-8-14(13)20-15/h2-9H,10H2,1H3