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

Systemtic Name: N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-4-fluoro-benzamide CAS Name: N-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-4-fluorobenzamide Traditional Name: N-[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]-4-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=C(C=C4)F

Isomeric SMILES

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

InChI

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