2-[2-[(1S)-2-azaniumyl-1-(diethylazaniumyl)ethyl]-6-methoxy-phenoxy]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-[(1S)-2-azaniumyl-1-(diethylazaniumyl)ethyl]-6-methoxy-phenoxy]ethyl-dimethyl-azanium Openeye Name: 2-[2-[(1S)-2-azaniumyl-1-(diethylammonio)ethyl]-6-methoxy-phenoxy]ethyl-dimethyl-ammonium CAS Name: 2-[2-[(1S)-2-ammonio-1-(diethylammonio)ethyl]-6-methoxyphenoxy]ethyl-dimethylammonium IUPAC Name: 2-[2-[(1S)-2-azaniumyl-1-(diethylazaniumyl)ethyl]-6-methoxyphenoxy]ethyl-dimethylazanium Traditional Name: 2-[2-[(1S)-2-ammonio-1-(diethylammonio)ethyl]-6-methoxy-phenoxy]ethyl-dimethyl-ammonium Formula: C17H34N3O2+3 MolecularWeight: 312.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C[NH3+])C1=C(C(=CC=C1)OC)OCC[NH+](C)C

Isomeric SMILES

CC[NH+](CC)[C@H](C[NH3+])C1=C(C(=CC=C1)OC)OCC[NH+](C)C

InChI

InChI=1S/C17H31N3O2/c1-6-20(7-2)15(13-18)14-9-8-10-16(21-5)17(14)22-12-11-19(3)4/h8-10,15H,6-7,11-13,18H2,1-5H3/p+3/t15-/m1/s1