[3-chloranyl-5-methoxy-4-[2-(4-phenylphenoxy)ethoxy]phenyl]methylazanium

Systemtic Name: [3-chloranyl-5-methoxy-4-[2-(4-phenylphenoxy)ethoxy]phenyl]methylazanium Openeye Name: [3-chloro-5-methoxy-4-[2-(4-phenylphenoxy)ethoxy]phenyl]methylammonium CAS Name: [3-chloro-5-methoxy-4-[2-(4-phenylphenoxy)ethoxy]phenyl]methylammonium IUPAC Name: [3-chloro-5-methoxy-4-[2-(4-phenylphenoxy)ethoxy]phenyl]methylazanium Traditional Name: [3-chloro-5-methoxy-4-[2-(4-phenylphenoxy)ethoxy]benzyl]ammonium Formula: C22H23ClNO3+ MolecularWeight: 384.87592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH3+])Cl)OCCOC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH3+])Cl)OCCOC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22ClNO3/c1-25-21-14-16(15-24)13-20(23)22(21)27-12-11-26-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10,13-14H,11-12,15,24H2,1H3/p+1