1,3-benzothiazol-2-ylmethyl 2,4,5-trimethoxybenzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2,4,5-trimethoxybenzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC2=NC3=CC=CC=C3S2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC2=NC3=CC=CC=C3S2)OC)OC

InChI

InChI=1S/C18H17NO5S/c1-21-13-9-15(23-3)14(22-2)8-11(13)18(20)24-10-17-19-12-6-4-5-7-16(12)25-17/h4-9H,10H2,1-3H3