[(2S)-3-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]-2-methyl-propyl]-dimethyl-azanium

Systemtic Name: [(2S)-3-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]-2-methyl-propyl]-dimethyl-azanium Openeye Name: [(2S)-3-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]-2-methyl-propyl]-dimethyl-ammonium CAS Name: [(2S)-3-[[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]amino]-2-methylpropyl]-dimethylammonium IUPAC Name: [(2S)-3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-2-methylpropyl]-dimethylazanium Traditional Name: [(2S)-3-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]-2-methyl-propyl]-dimethyl-ammonium Formula: C15H24ClN2O2+ MolecularWeight: 299.81626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NCC(C)C[NH+](C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC[C@H](C)C[NH+](C)C)Cl

InChI

InChI=1S/C15H23ClN2O2/c1-11(9-18(3)4)8-17-15(19)10-20-13-5-6-14(16)12(2)7-13/h5-7,11H,8-10H2,1-4H3,(H,17,19)/p+1/t11-/m0/s1