cyclohexyl-[(2S)-3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: cyclohexyl-[(2S)-3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: cyclohexyl-[(2S)-3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-methylammonium IUPAC Name: cyclohexyl-[(2S)-3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-methylazanium Traditional Name: cyclohexyl-[(2S)-3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C18H30NO2+ MolecularWeight: 292.4363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(C[NH+](C)C2CCCCC2)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC[C@H](C[NH+](C)C2CCCCC2)O)C

InChI

InChI=1S/C18H29NO2/c1-14-9-10-18(11-15(14)2)21-13-17(20)12-19(3)16-7-5-4-6-8-16/h9-11,16-17,20H,4-8,12-13H2,1-3H3/p+1/t17-/m0/s1