2-(1,2,3,4,4a,10a-hexahydrodibenzo-p-dioxin-1-yloxy)ethyl-methyl-di(propan-2-yl)azanium

Systemtic Name: 2-(1,2,3,4,4a,10a-hexahydrodibenzo-p-dioxin-1-yloxy)ethyl-methyl-di(propan-2-yl)azanium Openeye Name: 2-(1,2,3,4,4a,10a-hexahydrodibenzo-p-dioxin-1-yloxy)ethyl-diisopropyl-methyl-ammonium CAS Name: 2-(1,2,3,4,4a,10a-hexahydrodibenzo-p-dioxin-1-yloxy)ethyl-methyl-di(propan-2-yl)ammonium IUPAC Name: 2-(1,2,3,4,4a,10a-hexahydrodibenzo-p-dioxin-1-yloxy)ethyl-methyl-di(propan-2-yl)azanium Traditional Name: 2-(1,2,3,4,4a,10a-hexahydrodibenzo-p-dioxin-1-yloxy)ethyl-diisopropyl-methyl-ammonium Formula: C21H34NO3+ MolecularWeight: 348.49956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C)(CCOC1CCCC2C1OC3=CC=CC=C3O2)C(C)C

Isomeric SMILES

CC(C)[N+](C)(CCOC1CCCC2C1OC3=CC=CC=C3O2)C(C)C

InChI

InChI=1S/C21H34NO3/c1-15(2)22(5,16(3)4)13-14-23-19-11-8-12-20-21(19)25-18-10-7-6-9-17(18)24-20/h6-7,9-10,15-16,19-21H,8,11-14H2,1-5H3/q+1