8-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 8-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 8-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 8-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 8-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 8-(2,2-difluoro-1,3-benzodioxol-5-yl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C16H11F2NO3S MolecularWeight: 335.325246

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=CC(=C2)C3=CC4=C(C=C3)OC(O4)(F)F)NC1=O

Isomeric SMILES

C1CSC2=C(C=CC(=C2)C3=CC4=C(C=C3)OC(O4)(F)F)NC1=O

InChI

InChI=1S/C16H11F2NO3S/c17-16(18)21-12-4-2-9(7-13(12)22-16)10-1-3-11-14(8-10)23-6-5-15(20)19-11/h1-4,7-8H,5-6H2,(H,19,20)