cyclopentyl-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-yl]methyl]azanium

Systemtic Name: cyclopentyl-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-yl]methyl]azanium Openeye Name: cyclopentyl-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-yl]methyl]ammonium CAS Name: cyclopentyl-[[2-[4-(2-methoxyphenyl)-1-piperazinyl]-3-pyridin-1-iumyl]methyl]ammonium IUPAC Name: cyclopentyl-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-yl]methyl]azanium Traditional Name: cyclopentyl-[[2-[4-(2-methoxyphenyl)piperazino]pyridin-1-ium-3-yl]methyl]ammonium Formula: C22H32N4O+2 MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=CC=[NH+]3)C[NH2+]C4CCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=CC=[NH+]3)C[NH2+]C4CCCC4

InChI

InChI=1S/C22H30N4O/c1-27-21-11-5-4-10-20(21)25-13-15-26(16-14-25)22-18(7-6-12-23-22)17-24-19-8-2-3-9-19/h4-7,10-12,19,24H,2-3,8-9,13-17H2,1H3/p+2