3-bromanyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 3-bromanyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide Openeye Name: 3-bromo-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide CAS Name: 3-bromo-N-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-bromo-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide Traditional Name: 3-bromo-N-[4-(4-caprylylpiperazino)phenyl]benzamide Formula: C25H32BrN3O2 MolecularWeight: 486.44448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32BrN3O2/c1-2-3-4-5-6-10-24(30)29-17-15-28(16-18-29)23-13-11-22(12-14-23)27-25(31)20-8-7-9-21(26)19-20/h7-9,11-14,19H,2-6,10,15-18H2,1H3,(H,27,31)