[5-chloranyl-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]methylazanium

Systemtic Name: [5-chloranyl-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]methylazanium Openeye Name: [5-chloro-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]methylammonium CAS Name: [5-chloro-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]methylammonium IUPAC Name: [5-chloro-2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]methylazanium Traditional Name: [5-chloro-2-[2-(2,6-dimethylphenoxy)ethoxy]benzyl]ammonium Formula: C17H21ClNO2+ MolecularWeight: 306.80714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClNO2/c1-12-4-3-5-13(2)17(12)21-9-8-20-16-7-6-15(18)10-14(16)11-19/h3-7,10H,8-9,11,19H2,1-2H3/p+1