3-[3-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]propyl]-6-fluoranyl-1,2-benzoxazole

Systemtic Name: 3-[3-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]propyl]-6-fluoranyl-1,2-benzoxazole Openeye Name: 3-[3-[4-(1,2-benzoxazol-3-yl)-1-piperidyl]propyl]-6-fluoro-1,2-benzoxazole CAS Name: 3-[3-[4-(1,2-benzoxazol-3-yl)-1-piperidinyl]propyl]-6-fluoro-1,2-benzoxazole IUPAC Name: 3-[3-[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]propyl]-6-fluoro-1,2-benzoxazole Traditional Name: 6-fluoro-3-[3-(4-indoxazen-3-ylpiperidino)propyl]indoxazene Formula: C22H22FN3O2 MolecularWeight: 379.427383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NOC3=CC=CC=C32)CCCC4=NOC5=C4C=CC(=C5)F

Isomeric SMILES

C1CN(CCC1C2=NOC3=CC=CC=C32)CCCC4=NOC5=C4C=CC(=C5)F

InChI

InChI=1S/C22H22FN3O2/c23-16-7-8-17-19(24-28-21(17)14-16)5-3-11-26-12-9-15(10-13-26)22-18-4-1-2-6-20(18)27-25-22/h1-2,4,6-8,14-15H,3,5,9-13H2