[(3S)-1-(2-methylphenoxy)pentan-3-yl]azanium

Systemtic Name: [(3S)-1-(2-methylphenoxy)pentan-3-yl]azanium Openeye Name: [(1S)-1-ethyl-3-(2-methylphenoxy)propyl]ammonium CAS Name: [(3S)-1-(2-methylphenoxy)pentan-3-yl]ammonium IUPAC Name: [(3S)-1-(2-methylphenoxy)pentan-3-yl]azanium Traditional Name: [(1S)-1-ethyl-3-(2-methylphenoxy)propyl]ammonium Formula: C12H20NO+ MolecularWeight: 194.2933

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCOC1=CC=CC=C1C)[NH3+]

Isomeric SMILES

CC[C@@H](CCOC1=CC=CC=C1C)[NH3+]

InChI

InChI=1S/C12H19NO/c1-3-11(13)8-9-14-12-7-5-4-6-10(12)2/h4-7,11H,3,8-9,13H2,1-2H3/p+1/t11-/m0/s1