(3,4-dichlorophenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: (3,4-dichlorophenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: (3,4-dichlorophenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid (3,4-dichlorobenzyl) ester Formula: C17H13Cl2NO2S MolecularWeight: 366.26162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCC(=O)OCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCC(=O)OCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2NO2S/c18-12-6-5-11(9-13(12)19)10-22-17(21)8-7-16-20-14-3-1-2-4-15(14)23-16/h1-6,9H,7-8,10H2