[3,4-bis(fluoranyl)phenyl] 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: [3,4-bis(fluoranyl)phenyl] 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: (3,4-difluorophenyl) 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid (3,4-difluorophenyl) ester IUPAC Name: (3,4-difluorophenyl) 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid (3,4-difluorophenyl) ester Formula: C16H11F2NO2S MolecularWeight: 319.325846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCC(=O)OC3=CC(=C(C=C3)F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCC(=O)OC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C16H11F2NO2S/c17-11-6-5-10(9-12(11)18)21-16(20)8-7-15-19-13-3-1-2-4-14(13)22-15/h1-6,9H,7-8H2