[(2S)-2-(dimethylamino)-4-(3,4-dimethylphenoxy)butyl]azanium

Systemtic Name: [(2S)-2-(dimethylamino)-4-(3,4-dimethylphenoxy)butyl]azanium Openeye Name: [(2S)-2-(dimethylamino)-4-(3,4-dimethylphenoxy)butyl]ammonium CAS Name: [(2S)-2-(dimethylamino)-4-(3,4-dimethylphenoxy)butyl]ammonium IUPAC Name: [(2S)-2-(dimethylamino)-4-(3,4-dimethylphenoxy)butyl]azanium Traditional Name: [(2S)-2-(dimethylamino)-4-(3,4-dimethylphenoxy)butyl]ammonium Formula: C14H25N2O+ MolecularWeight: 237.3611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCC(C[NH3+])N(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC[C@@H](C[NH3+])N(C)C)C

InChI

InChI=1S/C14H24N2O/c1-11-5-6-14(9-12(11)2)17-8-7-13(10-15)16(3)4/h5-6,9,13H,7-8,10,15H2,1-4H3/p+1/t13-/m0/s1