3-iodanyl-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide

Systemtic Name: 3-iodanyl-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 3-iodo-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3-iodo-N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-iodo-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3-iodo-N-[4-(4-p-toluoylpiperazino)phenyl]benzamide Formula: C25H24IN3O2 MolecularWeight: 525.38143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)I

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)I

InChI

InChI=1S/C25H24IN3O2/c1-18-5-7-19(8-6-18)25(31)29-15-13-28(14-16-29)23-11-9-22(10-12-23)27-24(30)20-3-2-4-21(26)17-20/h2-12,17H,13-16H2,1H3,(H,27,30)