[5-chloranyl-2-[2-(4-propylphenoxy)ethoxy]phenyl]methylazanium

Systemtic Name: [5-chloranyl-2-[2-(4-propylphenoxy)ethoxy]phenyl]methylazanium Openeye Name: [5-chloro-2-[2-(4-propylphenoxy)ethoxy]phenyl]methylammonium CAS Name: [5-chloro-2-[2-(4-propylphenoxy)ethoxy]phenyl]methylammonium IUPAC Name: [5-chloro-2-[2-(4-propylphenoxy)ethoxy]phenyl]methylazanium Traditional Name: [5-chloro-2-[2-(4-propylphenoxy)ethoxy]benzyl]ammonium Formula: C18H23ClNO2+ MolecularWeight: 320.83372

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)C[NH3+]

Isomeric SMILES

CCCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)C[NH3+]

InChI

InChI=1S/C18H22ClNO2/c1-2-3-14-4-7-17(8-5-14)21-10-11-22-18-9-6-16(19)12-15(18)13-20/h4-9,12H,2-3,10-11,13,20H2,1H3/p+1