[3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylazanium

Systemtic Name: [3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylazanium Openeye Name: [3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylammonium CAS Name: [3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylammonium IUPAC Name: [3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylazanium Traditional Name: [3-[2-(2,3,6-trimethylphenoxy)ethoxy]benzyl]ammonium Formula: C18H24NO2+ MolecularWeight: 286.38866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCOC2=CC=CC(=C2)C[NH3+])C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCOC2=CC=CC(=C2)C[NH3+])C

InChI

InChI=1S/C18H23NO2/c1-13-7-8-14(2)18(15(13)3)21-10-9-20-17-6-4-5-16(11-17)12-19/h4-8,11H,9-10,12,19H2,1-3H3/p+1