2-[1-[(3E)-3-(2-chloranyl-7-fluoranyl-phenoxathiin-10-ylidene)propyl]piperidin-4-yl]ethanol

Systemtic Name: 2-[1-[(3E)-3-(2-chloranyl-7-fluoranyl-phenoxathiin-10-ylidene)propyl]piperidin-4-yl]ethanol Openeye Name: 2-[1-[(3E)-3-(2-chloro-7-fluoro-phenoxathiin-10-ylidene)propyl]-4-piperidyl]ethanol CAS Name: 2-[1-[(3E)-3-(2-chloro-7-fluoro-10-phenoxathiinylidene)propyl]-4-piperidinyl]ethanol IUPAC Name: 2-[1-[(3E)-3-(2-chloro-7-fluorophenoxathiin-10-ylidene)propyl]piperidin-4-yl]ethanol Traditional Name: 2-[1-[(3E)-3-(2-chloro-7-fluoro-phenoxathiin-10-ylidene)propyl]-4-piperidyl]ethanol Formula: C22H25ClFNO2S MolecularWeight: 421.955803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCO)CCC=S2C3=C(C=C(C=C3)F)OC4=C2C=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1CCO)CC/C=S/2\C3=C(C=C(C=C3)F)OC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C22H25ClFNO2S/c23-17-2-4-19-22(14-17)28(21-5-3-18(24)15-20(21)27-19)13-1-9-25-10-6-16(7-11-25)8-12-26/h2-5,13-16,26H,1,6-12H2