1-(4-fluorophenyl)-4-[4-(6-methoxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-[4-(6-methoxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-[4-(6-methoxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[4-(6-methoxy-1,2-benzoxazol-3-yl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-[4-(6-methoxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[4-(6-methoxyindoxazen-3-yl)piperazino]butan-1-one Formula: C22H24FN3O3 MolecularWeight: 397.442663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NO2)N3CCN(CC3)CCCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NO2)N3CCN(CC3)CCCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O3/c1-28-18-8-9-19-21(15-18)29-24-22(19)26-13-11-25(12-14-26)10-2-3-20(27)16-4-6-17(23)7-5-16/h4-9,15H,2-3,10-14H2,1H3