3-[[3-[2-(dimethylazaniumyl)ethoxy]-4-methoxy-phenyl]methylazaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[3-[2-(dimethylazaniumyl)ethoxy]-4-methoxy-phenyl]methylazaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[3-[2-(dimethylammonio)ethoxy]-4-methoxy-phenyl]methylammonio]propyl-dimethyl-ammonium CAS Name: 3-[[3-[2-(dimethylammonio)ethoxy]-4-methoxyphenyl]methylammonio]propyl-dimethylammonium IUPAC Name: 3-[[3-[2-(dimethylazaniumyl)ethoxy]-4-methoxyphenyl]methylazaniumyl]propyl-dimethylazanium Traditional Name: 3-[[3-[2-(dimethylammonio)ethoxy]-4-methoxy-benzyl]ammonio]propyl-dimethyl-ammonium Formula: C17H34N3O2+3 MolecularWeight: 312.47076

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC1=CC(=C(C=C1)OC)OCC[NH+](C)C

Isomeric SMILES

C[NH+](C)CCC[NH2+]CC1=CC(=C(C=C1)OC)OCC[NH+](C)C

InChI

InChI=1S/C17H31N3O2/c1-19(2)10-6-9-18-14-15-7-8-16(21-5)17(13-15)22-12-11-20(3)4/h7-8,13,18H,6,9-12,14H2,1-5H3/p+3