[3-[[(2S)-2-ethylhexoxy]methyl]phenyl]methylazanium

Systemtic Name: [3-[[(2S)-2-ethylhexoxy]methyl]phenyl]methylazanium Openeye Name: [3-[[(2S)-2-ethylhexoxy]methyl]phenyl]methylammonium CAS Name: [3-[[(2S)-2-ethylhexoxy]methyl]phenyl]methylammonium IUPAC Name: [3-[[(2S)-2-ethylhexoxy]methyl]phenyl]methylazanium Traditional Name: [3-[[(2S)-2-ethylhexoxy]methyl]benzyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCC1=CC=CC(=C1)C[NH3+]

Isomeric SMILES

CCCC[C@H](CC)COCC1=CC=CC(=C1)C[NH3+]

InChI

InChI=1S/C16H27NO/c1-3-5-7-14(4-2)12-18-13-16-9-6-8-15(10-16)11-17/h6,8-10,14H,3-5,7,11-13,17H2,1-2H3/p+1/t14-/m0/s1