(4,5-dimethoxy-2-methyl-phenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)CCC2=NC3=CC=CC=C3S2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)CCC2=NC3=CC=CC=C3S2)OC)OC

InChI

InChI=1S/C20H21NO4S/c1-13-10-16(23-2)17(24-3)11-14(13)12-25-20(22)9-8-19-21-15-6-4-5-7-18(15)26-19/h4-7,10-11H,8-9,12H2,1-3H3