[3-chloranyl-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylazanium

Systemtic Name: [3-chloranyl-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylazanium Openeye Name: [3-chloro-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylammonium CAS Name: [3-chloro-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylammonium IUPAC Name: [3-chloro-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylazanium Traditional Name: [3-chloro-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzyl]ammonium Formula: C20H27ClNO3+ MolecularWeight: 364.88628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH3+])Cl)OCCOC2=C(C=CC(=C2C)C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH3+])Cl)OCCOC2=C(C=CC(=C2C)C)C

InChI

InChI=1S/C20H26ClNO3/c1-5-23-18-11-16(12-22)10-17(21)20(18)25-9-8-24-19-14(3)7-6-13(2)15(19)4/h6-7,10-11H,5,8-9,12,22H2,1-4H3/p+1