4-tert-butyl-N-[2-(4-phenylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-(4-phenylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[2-(4-phenylpiperazin-1-yl)phenyl]benzamide CAS Name: 4-tert-butyl-N-[2-(4-phenyl-1-piperazinyl)phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-(4-phenylpiperazin-1-yl)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[2-(4-phenylpiperazino)phenyl]benzamide Formula: C27H31N3O MolecularWeight: 413.55454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O/c1-27(2,3)22-15-13-21(14-16-22)26(31)28-24-11-7-8-12-25(24)30-19-17-29(18-20-30)23-9-5-4-6-10-23/h4-16H,17-20H2,1-3H3,(H,28,31)