[(2S)-2-ethylhexyl]-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium

Systemtic Name: [(2S)-2-ethylhexyl]-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium Openeye Name: [(2S)-2-ethylhexyl]-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium CAS Name: [(2S)-2-ethylhexyl]-[(2S)-2-hydroxy-2-phenylethyl]ammonium IUPAC Name: [(2S)-2-ethylhexyl]-[(2S)-2-hydroxy-2-phenylethyl]azanium Traditional Name: [(2S)-2-ethylhexyl]-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]CC(C1=CC=CC=C1)O

Isomeric SMILES

CCCC[C@H](CC)C[NH2+]C[C@H](C1=CC=CC=C1)O

InChI

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