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

Systemtic Name: 3-bromanyl-N-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 3-bromo-N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3-bromo-N-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-bromo-N-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3-bromo-N-[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]benzamide Formula: C28H30BrN3O2 MolecularWeight: 520.4607

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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=C4)Br

Isomeric SMILES

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

InChI

InChI=1S/C28H30BrN3O2/c1-28(2,3)22-9-7-20(8-10-22)27(34)32-17-15-31(16-18-32)25-13-11-24(12-14-25)30-26(33)21-5-4-6-23(29)19-21/h4-14,19H,15-18H2,1-3H3,(H,30,33)