(5-chloranyl-2-oxidanyl-phenyl)methyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]azanium

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-[(1S,2R,3S)-2,3-dimethylcyclohexyl]azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-[(1S,2R,3S)-2,3-dimethylcyclohexyl]ammonium Formula: C15H23ClNO+ MolecularWeight: 268.80222

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)[NH2+]CC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)[NH2+]CC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C15H22ClNO/c1-10-4-3-5-14(11(10)2)17-9-12-8-13(16)6-7-15(12)18/h6-8,10-11,14,17-18H,3-5,9H2,1-2H3/p+1/t10-,11+,14-/m0/s1