1,3-benzothiazol-2-ylmethyl 2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(5,6-dimethylbenzofuran-3-yl)acetate CAS Name: 2-(5,6-dimethyl-3-benzofuranyl)acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(5,6-dimethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(5,6-dimethylbenzofuran-3-yl)acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H17NO3S MolecularWeight: 351.41888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)OCC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)OCC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C20H17NO3S/c1-12-7-15-14(10-23-17(15)8-13(12)2)9-20(22)24-11-19-21-16-5-3-4-6-18(16)25-19/h3-8,10H,9,11H2,1-2H3