N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazinyl]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[4-(3,3-dimethylbutanoyl)piperazino]phenyl]-2-fluoro-benzamide Formula: C23H28FN3O2 MolecularWeight: 397.485723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C23H28FN3O2/c1-23(2,3)16-21(28)27-14-12-26(13-15-27)18-10-8-17(9-11-18)25-22(29)19-6-4-5-7-20(19)24/h4-11H,12-16H2,1-3H3,(H,25,29)