(3-chloranyl-5-ethoxy-4-prop-2-enoxy-phenyl)methyl-(2-dimethylaminoethyl)azanium

Systemtic Name: (3-chloranyl-5-ethoxy-4-prop-2-enoxy-phenyl)methyl-(2-dimethylaminoethyl)azanium Openeye Name: (4-allyloxy-3-chloro-5-ethoxy-phenyl)methyl-(2-dimethylaminoethyl)ammonium CAS Name: (3-chloro-5-ethoxy-4-prop-2-enoxyphenyl)methyl-(2-dimethylaminoethyl)ammonium IUPAC Name: (3-chloro-5-ethoxy-4-prop-2-enoxyphenyl)methyl-(2-dimethylaminoethyl)azanium Traditional Name: (4-allyloxy-3-chloro-5-ethoxy-benzyl)-(2-dimethylaminoethyl)ammonium Formula: C16H26ClN2O2+ MolecularWeight: 313.84284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCN(C)C)Cl)OCC=C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCN(C)C)Cl)OCC=C

InChI

InChI=1S/C16H25ClN2O2/c1-5-9-21-16-14(17)10-13(11-15(16)20-6-2)12-18-7-8-19(3)4/h5,10-11,18H,1,6-9,12H2,2-4H3/p+1