N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]-2-fluoro-benzamide Formula: C28H30FN3O2 MolecularWeight: 459.555103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C28H30FN3O2/c1-28(2,3)21-10-8-20(9-11-21)27(34)32-18-16-31(17-19-32)23-14-12-22(13-15-23)30-26(33)24-6-4-5-7-25(24)29/h4-15H,16-19H2,1-3H3,(H,30,33)