[(2S)-3-(4-chloranyl-3,5-dimethyl-phenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(4-chloranyl-3,5-dimethyl-phenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(4-chloro-3,5-dimethyl-phenoxy)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(4-chloro-3,5-dimethylphenoxy)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(4-chloro-3,5-dimethylphenoxy)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(4-chloro-3,5-dimethyl-phenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C12H19ClNO2+ MolecularWeight: 244.73776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(C[NH2+]C)O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC[C@H](C[NH2+]C)O

InChI

InChI=1S/C12H18ClNO2/c1-8-4-11(5-9(2)12(8)13)16-7-10(15)6-14-3/h4-5,10,14-15H,6-7H2,1-3H3/p+1/t10-/m0/s1