1-(4-fluorophenyl)-2-[4-(5-oxidanyl-1,2-benzoxazol-3-yl)piperazin-1-yl]butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-2-[4-(5-oxidanyl-1,2-benzoxazol-3-yl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-fluorophenyl)-2-[4-(5-hydroxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butan-1-one CAS Name: 1-(4-fluorophenyl)-2-[4-(5-hydroxy-1,2-benzoxazol-3-yl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-2-[4-(5-hydroxy-1,2-benzoxazol-3-yl)piperazin-1-yl]butan-1-one Traditional Name: 1-(4-fluorophenyl)-2-[4-(5-hydroxyindoxazen-3-yl)piperazino]butan-1-one Formula: C21H22FN3O3 MolecularWeight: 383.416083

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=C(C=C1)F)N2CCN(CC2)C3=NOC4=C3C=C(C=C4)O

Isomeric SMILES

CCC(C(=O)C1=CC=C(C=C1)F)N2CCN(CC2)C3=NOC4=C3C=C(C=C4)O

InChI

InChI=1S/C21H22FN3O3/c1-2-18(20(27)14-3-5-15(22)6-4-14)24-9-11-25(12-10-24)21-17-13-16(26)7-8-19(17)28-23-21/h3-8,13,18,26H,2,9-12H2,1H3