N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-2-chloranyl-benzamide

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-2-chloranyl-benzamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]-2-chloro-benzamide CAS Name: 2-chloro-N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-2-chlorobenzamide Traditional Name: N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]-2-chloro-benzamide Formula: C21H23Cl2N3O2 MolecularWeight: 420.33222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3Cl)Cl

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O2/c1-2-5-20(27)26-12-10-25(11-13-26)19-9-8-15(14-18(19)23)24-21(28)16-6-3-4-7-17(16)22/h3-4,6-9,14H,2,5,10-13H2,1H3,(H,24,28)