[(3R)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-(1-methylpiperidin-1-ium-4-yl)methanone

Systemtic Name: [(3R)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-(1-methylpiperidin-1-ium-4-yl)methanone Openeye Name: [(3R)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-piperidyl]-(1-methylpiperidin-1-ium-4-yl)methanone CAS Name: [(3R)-3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-piperidinyl]-(1-methyl-4-piperidin-1-iumyl)methanone IUPAC Name: [(3R)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]-(1-methylpiperidin-1-ium-4-yl)methanone Traditional Name: [(3R)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]piperidino]-(1-methylpiperidin-1-ium-4-yl)methanone Formula: C23H38N4O2+2 MolecularWeight: 402.57342

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)C(=O)N2CCCC(C2)[NH+]3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

C[NH+]1CCC(CC1)C(=O)N2CCC[C@H](C2)[NH+]3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C23H36N4O2/c1-24-12-9-19(10-13-24)23(28)27-11-5-6-20(18-27)25-14-16-26(17-15-25)21-7-3-4-8-22(21)29-2/h3-4,7-8,19-20H,5-6,9-18H2,1-2H3/p+2/t20-/m1/s1