[3-[1-(2-cyanophenyl)ethoxy]-2-oxidanyl-propyl]-dimethyl-(2-naphthalen-2-ylethyl)azanium

Systemtic Name: [3-[1-(2-cyanophenyl)ethoxy]-2-oxidanyl-propyl]-dimethyl-(2-naphthalen-2-ylethyl)azanium Openeye Name: [3-[1-(2-cyanophenyl)ethoxy]-2-hydroxy-propyl]-dimethyl-[2-(2-naphthyl)ethyl]ammonium CAS Name: [3-[1-(2-cyanophenyl)ethoxy]-2-hydroxypropyl]-dimethyl-[2-(2-naphthalenyl)ethyl]ammonium IUPAC Name: [3-[1-(2-cyanophenyl)ethoxy]-2-hydroxypropyl]-dimethyl-(2-naphthalen-2-ylethyl)azanium Traditional Name: [3-[1-(2-cyanophenyl)ethoxy]-2-hydroxy-propyl]-dimethyl-[2-(2-naphthyl)ethyl]ammonium Formula: C26H31N2O2+ MolecularWeight: 403.53654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1C#N)OCC(C[N+](C)(C)CCC2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

CC(C1=CC=CC=C1C#N)OCC(C[N+](C)(C)CCC2=CC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C26H31N2O2/c1-20(26-11-7-6-10-24(26)17-27)30-19-25(29)18-28(2,3)15-14-21-12-13-22-8-4-5-9-23(22)16-21/h4-13,16,20,25,29H,14-15,18-19H2,1-3H3/q+1