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

Systemtic Name: 4-tert-butyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-(4-caprylylpiperazino)phenyl]benzamide Formula: C29H41N3O2 MolecularWeight: 463.65474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H41N3O2/c1-5-6-7-8-9-10-27(33)32-21-19-31(20-22-32)26-17-15-25(16-18-26)30-28(34)23-11-13-24(14-12-23)29(2,3)4/h11-18H,5-10,19-22H2,1-4H3,(H,30,34)