azocan-1-yl-[3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxyphenyl]methanone

Systemtic Name: azocan-1-yl-[3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxyphenyl]methanone Openeye Name: azocan-1-yl-[3-[[1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]oxy]phenyl]methanone CAS Name: 1-azocanyl-[3-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidinyl]oxy]phenyl]methanone IUPAC Name: azocan-1-yl-[3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-4-yl]oxyphenyl]methanone Traditional Name: azocan-1-yl-[3-[[1-(1-methylpiperidin-1-ium-4-yl)-4-piperidyl]oxy]phenyl]methanone Formula: C25H40N3O2+ MolecularWeight: 414.604

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCC(CC2)OC3=CC=CC(=C3)C(=O)N4CCCCCCC4

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC(CC2)OC3=CC=CC(=C3)C(=O)N4CCCCCCC4

InChI

InChI=1S/C25H39N3O2/c1-26-16-10-22(11-17-26)27-18-12-23(13-19-27)30-24-9-7-8-21(20-24)25(29)28-14-5-3-2-4-6-15-28/h7-9,20,22-23H,2-6,10-19H2,1H3/p+1