2-[4-[(1S)-2-azaniumyl-1-(4-methylpiperidin-1-ium-1-yl)ethyl]phenoxy]ethyl-dimethyl-azanium

Systemtic Name: 2-[4-[(1S)-2-azaniumyl-1-(4-methylpiperidin-1-ium-1-yl)ethyl]phenoxy]ethyl-dimethyl-azanium Openeye Name: 2-[4-[(1S)-2-azaniumyl-1-(4-methylpiperidin-1-ium-1-yl)ethyl]phenoxy]ethyl-dimethyl-ammonium CAS Name: 2-[4-[(1S)-2-ammonio-1-(4-methyl-1-piperidin-1-iumyl)ethyl]phenoxy]ethyl-dimethylammonium IUPAC Name: 2-[4-[(1S)-2-azaniumyl-1-(4-methylpiperidin-1-ium-1-yl)ethyl]phenoxy]ethyl-dimethylazanium Traditional Name: 2-[4-[(1S)-2-ammonio-1-(4-methylpiperidin-1-ium-1-yl)ethyl]phenoxy]ethyl-dimethyl-ammonium Formula: C18H34N3O+3 MolecularWeight: 308.48206

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C[NH3+])C2=CC=C(C=C2)OCC[NH+](C)C

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](C[NH3+])C2=CC=C(C=C2)OCC[NH+](C)C

InChI

InChI=1S/C18H31N3O/c1-15-8-10-21(11-9-15)18(14-19)16-4-6-17(7-5-16)22-13-12-20(2)3/h4-7,15,18H,8-14,19H2,1-3H3/p+3/t18-/m1/s1