(5-ethanoyl-2-ethoxy-phenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H21NO4S/c1-3-25-18-9-8-15(14(2)23)12-16(18)13-26-21(24)11-10-20-22-17-6-4-5-7-19(17)27-20/h4-9,12H,3,10-11,13H2,1-2H3