3-[4-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperazin-1-yl]-2H-1,2-benzoxazol-6-one hydrobromide

Systemtic Name: 3-[4-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperazin-1-yl]-2H-1,2-benzoxazol-6-one hydrobromide Openeye Name: 3-[4-[4-(4-fluorophenyl)-4-oxo-butyl]piperazin-1-yl]-2H-1,2-benzoxazol-6-one hydrobromide CAS Name: 3-[4-[4-(4-fluorophenyl)-4-oxobutyl]-1-piperazinyl]-2H-1,2-benzoxazol-6-one hydrobromide IUPAC Name: 3-[4-[4-(4-fluorophenyl)-4-oxobutyl]piperazin-1-yl]-2H-1,2-benzoxazol-6-one hydrobromide Traditional Name: 3-[4-[4-(4-fluorophenyl)-4-keto-butyl]piperazino]-2H-indoxazen-6-one hydrobromide Formula: C21H23BrFN3O3 MolecularWeight: 464.328023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=C4C=CC(=O)C=C4ON3.Br

Isomeric SMILES

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=C4C=CC(=O)C=C4ON3.Br

InChI

InChI=1S/C21H22FN3O3.BrH/c22-16-5-3-15(4-6-16)19(27)2-1-9-24-10-12-25(13-11-24)21-18-8-7-17(26)14-20(18)28-23-21;/h3-8,14,23H,1-2,9-13H2;1H