[4-(5-chloranyl-2-methyl-phenyl)piperazin-4-ium-1-yl]-(4-chlorophenyl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-4-ium-1-yl]-(4-chlorophenyl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-4-ium-1-yl]-(4-chlorophenyl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazin-4-iumyl]-(4-chlorophenyl)methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-4-ium-1-yl]-(4-chlorophenyl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazin-4-ium-1-yl]-(4-chlorophenyl)methanone Formula: C18H19Cl2N2O+ MolecularWeight: 350.26226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18Cl2N2O/c1-13-2-5-16(20)12-17(13)21-8-10-22(11-9-21)18(23)14-3-6-15(19)7-4-14/h2-7,12H,8-11H2,1H3/p+1