N-[4-[4-(3-fluoranyl-5-methoxy-phenyl)piperazin-1-yl]butyl]-2,1,3-benzoxadiazole-5-carboxamide

Systemtic Name: N-[4-[4-(3-fluoranyl-5-methoxy-phenyl)piperazin-1-yl]butyl]-2,1,3-benzoxadiazole-5-carboxamide Openeye Name: N-[4-[4-(3-fluoro-5-methoxy-phenyl)piperazin-1-yl]butyl]-2,1,3-benzoxadiazole-5-carboxamide CAS Name: N-[4-[4-(3-fluoro-5-methoxyphenyl)-1-piperazinyl]butyl]-2,1,3-benzoxadiazole-5-carboxamide IUPAC Name: N-[4-[4-(3-fluoro-5-methoxyphenyl)piperazin-1-yl]butyl]-2,1,3-benzoxadiazole-5-carboxamide Traditional Name: N-[4-[4-(3-fluoro-5-methoxy-phenyl)piperazino]butyl]benzofurazan-5-carboxamide Formula: C22H26FN5O3 MolecularWeight: 427.471943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2CCN(CC2)CCCCNC(=O)C3=CC4=NON=C4C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1)N2CCN(CC2)CCCCNC(=O)C3=CC4=NON=C4C=C3)F

InChI

InChI=1S/C22H26FN5O3/c1-30-19-14-17(23)13-18(15-19)28-10-8-27(9-11-28)7-3-2-6-24-22(29)16-4-5-20-21(12-16)26-31-25-20/h4-5,12-15H,2-3,6-11H2,1H3,(H,24,29)