[(2S)-2-ethylhexyl]-[(1R)-1-(2-hydroxyphenyl)ethyl]azanium

Systemtic Name: [(2S)-2-ethylhexyl]-[(1R)-1-(2-hydroxyphenyl)ethyl]azanium Openeye Name: [(2S)-2-ethylhexyl]-[(1R)-1-(2-hydroxyphenyl)ethyl]ammonium CAS Name: [(2S)-2-ethylhexyl]-[(1R)-1-(2-hydroxyphenyl)ethyl]ammonium IUPAC Name: [(2S)-2-ethylhexyl]-[(1R)-1-(2-hydroxyphenyl)ethyl]azanium Traditional Name: [(2S)-2-ethylhexyl]-[(1R)-1-(2-hydroxyphenyl)ethyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]C(C)C1=CC=CC=C1O

Isomeric SMILES

CCCC[C@H](CC)C[NH2+][C@H](C)C1=CC=CC=C1O

InChI

InChI=1S/C16H27NO/c1-4-6-9-14(5-2)12-17-13(3)15-10-7-8-11-16(15)18/h7-8,10-11,13-14,17-18H,4-6,9,12H2,1-3H3/p+1/t13-,14+/m1/s1