[4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-ethyl-piperidin-1-ium-4-yl]methylazanium

Systemtic Name: [4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-ethyl-piperidin-1-ium-4-yl]methylazanium Openeye Name: [4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-ethyl-piperidin-1-ium-4-yl]methylammonium CAS Name: [4-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-1-ethyl-4-piperidin-1-iumyl]methylammonium IUPAC Name: [4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-ethylpiperidin-1-ium-4-yl]methylazanium Traditional Name: [4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-ethyl-piperidin-1-ium-4-yl]methylammonium Formula: C18H32ClN4+3 MolecularWeight: 339.92648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)(C[NH3+])[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC[NH+]1CCC(CC1)(C[NH3+])[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H29ClN4/c1-2-21-8-6-18(15-20,7-9-21)23-12-10-22(11-13-23)17-5-3-4-16(19)14-17/h3-5,14H,2,6-13,15,20H2,1H3/p+3