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

Systemtic Name: [4-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-methyl-piperidin-1-ium-4-yl]methylazanium Openeye Name: [4-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-methyl-piperidin-1-ium-4-yl]methylammonium CAS Name: [4-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-1-methyl-4-piperidin-1-iumyl]methylammonium IUPAC Name: [4-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-methylpiperidin-1-ium-4-yl]methylazanium Traditional Name: [4-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-methyl-piperidin-1-ium-4-yl]methylammonium Formula: C18H33N4O+3 MolecularWeight: 321.48082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N4O/c1-20-9-7-18(15-19,8-10-20)22-13-11-21(12-14-22)16-3-5-17(23-2)6-4-16/h3-6H,7-15,19H2,1-2H3/p+3