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

Systemtic Name: 3-[4-[1-(4-fluorophenyl)-1-oxidanylidene-butan-2-yl]piperazin-1-yl]-2H-1,2-benzoxazol-4-one Openeye Name: 3-[4-[1-(4-fluorobenzoyl)propyl]piperazin-1-yl]-2H-1,2-benzoxazol-4-one CAS Name: 3-[4-[1-(4-fluorophenyl)-1-oxobutan-2-yl]-1-piperazinyl]-2H-1,2-benzoxazol-4-one IUPAC Name: 3-[4-[1-(4-fluorophenyl)-1-oxobutan-2-yl]piperazin-1-yl]-2H-1,2-benzoxazol-4-one Traditional Name: 3-[4-[1-(4-fluorobenzoyl)propyl]piperazino]-2H-indoxazen-4-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=C4C(=O)C=CC=C4ON3

Isomeric SMILES

CCC(C(=O)C1=CC=C(C=C1)F)N2CCN(CC2)C3=C4C(=O)C=CC=C4ON3

InChI

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