2-[3-chloranyl-5-ethoxy-4-[2-(4-propylphenoxy)ethoxy]phenyl]ethylazanium

Systemtic Name: 2-[3-chloranyl-5-ethoxy-4-[2-(4-propylphenoxy)ethoxy]phenyl]ethylazanium Openeye Name: 2-[3-chloro-5-ethoxy-4-[2-(4-propylphenoxy)ethoxy]phenyl]ethylammonium CAS Name: 2-[3-chloro-5-ethoxy-4-[2-(4-propylphenoxy)ethoxy]phenyl]ethylammonium IUPAC Name: 2-[3-chloro-5-ethoxy-4-[2-(4-propylphenoxy)ethoxy]phenyl]ethylazanium Traditional Name: 2-[3-chloro-5-ethoxy-4-[2-(4-propylphenoxy)ethoxy]phenyl]ethylammonium Formula: C21H29ClNO3+ MolecularWeight: 378.91286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Cl)CC[NH3+])OCC

Isomeric SMILES

CCCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Cl)CC[NH3+])OCC

InChI

InChI=1S/C21H28ClNO3/c1-3-5-16-6-8-18(9-7-16)25-12-13-26-21-19(22)14-17(10-11-23)15-20(21)24-4-2/h6-9,14-15H,3-5,10-13,23H2,1-2H3/p+1