2-(2-chloranyl-3,6-dimethyl-phenoxy)ethyl-ethyl-azanium

Systemtic Name: 2-(2-chloranyl-3,6-dimethyl-phenoxy)ethyl-ethyl-azanium Openeye Name: 2-(2-chloro-3,6-dimethyl-phenoxy)ethyl-ethyl-ammonium CAS Name: 2-(2-chloro-3,6-dimethylphenoxy)ethyl-ethylammonium IUPAC Name: 2-(2-chloro-3,6-dimethylphenoxy)ethyl-ethylazanium Traditional Name: 2-(2-chloro-3,6-dimethyl-phenoxy)ethyl-ethyl-ammonium Formula: C12H19ClNO+ MolecularWeight: 228.73836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CCOC1=C(C=CC(=C1Cl)C)C

Isomeric SMILES

CC[NH2+]CCOC1=C(C=CC(=C1Cl)C)C

InChI

InChI=1S/C12H18ClNO/c1-4-14-7-8-15-12-10(3)6-5-9(2)11(12)13/h5-6,14H,4,7-8H2,1-3H3/p+1