2-hydroxyethyl-[(2S,5R)-5-(2-methylphenoxy)hexan-2-yl]azanium

Systemtic Name: 2-hydroxyethyl-[(2S,5R)-5-(2-methylphenoxy)hexan-2-yl]azanium Openeye Name: 2-hydroxyethyl-[(1S,4R)-1-methyl-4-(2-methylphenoxy)pentyl]ammonium CAS Name: 2-hydroxyethyl-[(2S,5R)-5-(2-methylphenoxy)hexan-2-yl]ammonium IUPAC Name: 2-hydroxyethyl-[(2S,5R)-5-(2-methylphenoxy)hexan-2-yl]azanium Traditional Name: 2-hydroxyethyl-[(1S,4R)-1-methyl-4-(2-methylphenoxy)pentyl]ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(C)CCC(C)[NH2+]CCO

Isomeric SMILES

CC1=CC=CC=C1O[C@H](C)CC[C@H](C)[NH2+]CCO

InChI

InChI=1S/C15H25NO2/c1-12-6-4-5-7-15(12)18-14(3)9-8-13(2)16-10-11-17/h4-7,13-14,16-17H,8-11H2,1-3H3/p+1/t13-,14+/m0/s1