trimethyl-[[2-oxidanyl-5-[[4-oxidanyl-3-[(trimethylazaniumyl)methyl]phenyl]methyl]phenyl]methyl]azanium

Systemtic Name: trimethyl-[[2-oxidanyl-5-[[4-oxidanyl-3-[(trimethylazaniumyl)methyl]phenyl]methyl]phenyl]methyl]azanium Openeye Name: [2-hydroxy-5-[[4-hydroxy-3-[(trimethylammonio)methyl]phenyl]methyl]phenyl]methyl-trimethyl-ammonium CAS Name: [2-hydroxy-5-[[4-hydroxy-3-[(trimethylammonio)methyl]phenyl]methyl]phenyl]methyl-trimethylammonium IUPAC Name: [2-hydroxy-5-[[4-hydroxy-3-[(trimethylazaniumyl)methyl]phenyl]methyl]phenyl]methyl-trimethylazanium Traditional Name: [2-hydroxy-5-[4-hydroxy-3-[(trimethylammonio)methyl]benzyl]benzyl]-trimethyl-ammonium Formula: C21H32N2O2+2 MolecularWeight: 344.49098

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)O)C[N+](C)(C)C)O

Isomeric SMILES

C[N+](C)(C)CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)O)C[N+](C)(C)C)O

InChI

InChI=1S/C21H30N2O2/c1-22(2,3)14-18-12-16(7-9-20(18)24)11-17-8-10-21(25)19(13-17)15-23(4,5)6/h7-10,12-13H,11,14-15H2,1-6H3/p+2