[(1S,2S)-2-(3-hydroxyphenyl)-2-oxidanyl-cyclohexyl]methylazanium

Systemtic Name: [(1S,2S)-2-(3-hydroxyphenyl)-2-oxidanyl-cyclohexyl]methylazanium Openeye Name: [(1S,2S)-2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylammonium CAS Name: [(1S,2S)-2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylammonium IUPAC Name: [(1S,2S)-2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylazanium Traditional Name: [(1S,2S)-2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methylammonium Formula: C13H20NO2+ MolecularWeight: 222.3034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C[NH3+])(C2=CC(=CC=C2)O)O

Isomeric SMILES

C1CC[C@]([C@@H](C1)C[NH3+])(C2=CC(=CC=C2)O)O

InChI

InChI=1S/C13H19NO2/c14-9-11-4-1-2-7-13(11,16)10-5-3-6-12(15)8-10/h3,5-6,8,11,15-16H,1-2,4,7,9,14H2/p+1/t11-,13+/m0/s1