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

Systemtic Name: cyclohexyl-methyl-[(2S)-3-(4-methylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: cyclohexyl-[(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]-methylammonium IUPAC Name: cyclohexyl-[(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]-methylazanium Traditional Name: cyclohexyl-[(2S)-2-hydroxy-3-(4-methylphenoxy)propyl]-methyl-ammonium Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO2/c1-14-8-10-17(11-9-14)20-13-16(19)12-18(2)15-6-4-3-5-7-15/h8-11,15-16,19H,3-7,12-13H2,1-2H3/p+1/t16-/m0/s1