1,3-benzothiazol-2-ylmethyl 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H21NO5S/c1-23-15-10-13(11-16(24-2)20(15)25-3)8-9-19(22)26-12-18-21-14-6-4-5-7-17(14)27-18/h4-7,10-11H,8-9,12H2,1-3H3