[(2S)-4-(3-tert-butylphenoxy)-2-(dimethylamino)butyl]azanium

Systemtic Name: [(2S)-4-(3-tert-butylphenoxy)-2-(dimethylamino)butyl]azanium Openeye Name: [(2S)-4-(3-tert-butylphenoxy)-2-(dimethylamino)butyl]ammonium CAS Name: [(2S)-4-(3-tert-butylphenoxy)-2-(dimethylamino)butyl]ammonium IUPAC Name: [(2S)-4-(3-tert-butylphenoxy)-2-(dimethylamino)butyl]azanium Traditional Name: [(2S)-4-(3-tert-butylphenoxy)-2-(dimethylamino)butyl]ammonium Formula: C16H29N2O+ MolecularWeight: 265.41426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2O/c1-16(2,3)13-7-6-8-15(11-13)19-10-9-14(12-17)18(4)5/h6-8,11,14H,9-10,12,17H2,1-5H3/p+1/t14-/m0/s1