2-[3,5-bis(hydroxymethyl)-4-oxidanyl-phenyl]ethyl-dimethyl-(phenylmethyl)azanium

Systemtic Name: 2-[3,5-bis(hydroxymethyl)-4-oxidanyl-phenyl]ethyl-dimethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]ethyl]-dimethyl-ammonium CAS Name: 2-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]ethyl-dimethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[4-hydroxy-3,5-bis(hydroxymethyl)phenyl]ethyl]-dimethylazanium Traditional Name: benzyl-[2-(4-hydroxy-3,5-dimethylol-phenyl)ethyl]-dimethyl-ammonium Formula: C19H26NO3+ MolecularWeight: 316.41464

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC1=CC(=C(C(=C1)CO)O)CO)CC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(CCC1=CC(=C(C(=C1)CO)O)CO)CC2=CC=CC=C2

InChI

InChI=1S/C19H25NO3/c1-20(2,12-15-6-4-3-5-7-15)9-8-16-10-17(13-21)19(23)18(11-16)14-22/h3-7,10-11,21-22H,8-9,12-14H2,1-2H3/p+1