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

Systemtic Name: [4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-methyl-piperidin-1-ium-4-yl]methylazanium Openeye Name: [4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-methyl-piperidin-1-ium-4-yl]methylammonium CAS Name: [4-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-1-methyl-4-piperidin-1-iumyl]methylammonium IUPAC Name: [4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-methylpiperidin-1-ium-4-yl]methylazanium Traditional Name: [4-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-1-methyl-piperidin-1-ium-4-yl]methylammonium Formula: C17H30ClN4+3 MolecularWeight: 325.8999

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27ClN4/c1-20-7-5-17(14-19,6-8-20)22-11-9-21(10-12-22)16-4-2-3-15(18)13-16/h2-4,13H,5-12,14,19H2,1H3/p+3