2-[[(2S)-2-(4-chloranyl-3,5-dimethyl-phenoxy)propanoyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(2S)-2-(4-chloranyl-3,5-dimethyl-phenoxy)propanoyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(2S)-2-(4-chloro-3,5-dimethyl-phenoxy)propanoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2S)-2-(4-chloro-3,5-dimethylphenoxy)-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(2S)-2-(4-chloro-3,5-dimethylphenoxy)propanoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(2S)-2-(4-chloro-3,5-dimethyl-phenoxy)propanoyl]amino]ethyl-dimethyl-ammonium Formula: C15H24ClN2O2+ MolecularWeight: 299.81626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(C)C(=O)NCC[NH+](C)C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)O[C@@H](C)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C15H23ClN2O2/c1-10-8-13(9-11(2)14(10)16)20-12(3)15(19)17-6-7-18(4)5/h8-9,12H,6-7H2,1-5H3,(H,17,19)/p+1/t12-/m0/s1