1,3-benzothiazol-2-ylmethyl 3,5-dimethoxy-4-methyl-benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3,5-dimethoxy-4-methyl-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3,5-dimethoxy-4-methyl-benzoate CAS Name: 3,5-dimethoxy-4-methylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3,5-dimethoxy-4-methylbenzoate Traditional Name: 3,5-dimethoxy-4-methyl-benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)OCC2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)OCC2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C18H17NO4S/c1-11-14(21-2)8-12(9-15(11)22-3)18(20)23-10-17-19-13-6-4-5-7-16(13)24-17/h4-9H,10H2,1-3H3