3-(4-chloranyl-2,6-dimethyl-phenoxy)propyl-ethyl-azanium

Systemtic Name: 3-(4-chloranyl-2,6-dimethyl-phenoxy)propyl-ethyl-azanium Openeye Name: 3-(4-chloro-2,6-dimethyl-phenoxy)propyl-ethyl-ammonium CAS Name: 3-(4-chloro-2,6-dimethylphenoxy)propyl-ethylammonium IUPAC Name: 3-(4-chloro-2,6-dimethylphenoxy)propyl-ethylazanium Traditional Name: 3-(4-chloro-2,6-dimethyl-phenoxy)propyl-ethyl-ammonium Formula: C13H21ClNO+ MolecularWeight: 242.76494

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CCCOC1=C(C=C(C=C1C)Cl)C

Isomeric SMILES

CC[NH2+]CCCOC1=C(C=C(C=C1C)Cl)C

InChI

InChI=1S/C13H20ClNO/c1-4-15-6-5-7-16-13-10(2)8-12(14)9-11(13)3/h8-9,15H,4-7H2,1-3H3/p+1