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

Systemtic Name: 4-chloranyl-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-chloro-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide CAS Name: 4-chloro-N-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-chloro-N-[4-(4-octanoylpiperazin-1-yl)phenyl]benzamide Traditional Name: N-[4-(4-caprylylpiperazino)phenyl]-4-chloro-benzamide Formula: C25H32ClN3O2 MolecularWeight: 441.99348

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C25H32ClN3O2/c1-2-3-4-5-6-7-24(30)29-18-16-28(17-19-29)23-14-12-22(13-15-23)27-25(31)20-8-10-21(26)11-9-20/h8-15H,2-7,16-19H2,1H3,(H,27,31)