tert-butyl-[(2R)-3-(2-chloranyl-4-cyclohexyl-phenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2R)-3-(2-chloranyl-4-cyclohexyl-phenoxy)-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2R)-3-(2-chloro-4-cyclohexyl-phenoxy)-2-hydroxy-propyl]ammonium CAS Name: tert-butyl-[(2R)-3-(2-chloro-4-cyclohexylphenoxy)-2-hydroxypropyl]ammonium IUPAC Name: tert-butyl-[(2R)-3-(2-chloro-4-cyclohexylphenoxy)-2-hydroxypropyl]azanium Traditional Name: tert-butyl-[(2R)-3-(2-chloro-4-cyclohexyl-phenoxy)-2-hydroxy-propyl]ammonium Formula: C19H31ClNO2+ MolecularWeight: 340.90794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(COC1=C(C=C(C=C1)C2CCCCC2)Cl)O

Isomeric SMILES

CC(C)(C)[NH2+]C[C@H](COC1=C(C=C(C=C1)C2CCCCC2)Cl)O

InChI

InChI=1S/C19H30ClNO2/c1-19(2,3)21-12-16(22)13-23-18-10-9-15(11-17(18)20)14-7-5-4-6-8-14/h9-11,14,16,21-22H,4-8,12-13H2,1-3H3/p+1/t16-/m1/s1