[4-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]phenyl]methylazanium

Systemtic Name: [4-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]phenyl]methylazanium Openeye Name: [4-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]phenyl]methylammonium CAS Name: [4-[2-(2-tert-butyl-4-ethylphenoxy)ethoxy]phenyl]methylammonium IUPAC Name: [4-[2-(2-tert-butyl-4-ethylphenoxy)ethoxy]phenyl]methylazanium Traditional Name: [4-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]benzyl]ammonium Formula: C21H30NO2+ MolecularWeight: 328.4684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCOC2=CC=C(C=C2)C[NH3+])C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCOC2=CC=C(C=C2)C[NH3+])C(C)(C)C

InChI

InChI=1S/C21H29NO2/c1-5-16-8-11-20(19(14-16)21(2,3)4)24-13-12-23-18-9-6-17(15-22)7-10-18/h6-11,14H,5,12-13,15,22H2,1-4H3/p+1