(2S)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)-2-methyl-propan-2-ol; sulfuric acid

Systemtic Name: (2S)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)-2-methyl-propan-2-ol; sulfuric acid Openeye Name: (2S)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)-2-methyl-propan-2-ol; sulfuric acid CAS Name: (2S)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)-2-methyl-2-propanol; sulfuric acid IUPAC Name: (2S)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)-2-methylpropan-2-ol; sulfuric acid Traditional Name: (2S)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)-2-methyl-propan-2-ol; sulfuric acid Formula: C38H64N2O8S MolecularWeight: 708.98836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(C)(COC1=CC=CC=C1C2CCCC2)O.CC(C)(C)NCC(C)(COC1=CC=CC=C1C2CCCC2)O.OS(=O)(=O)O

Isomeric SMILES

C[C@](CNC(C)(C)C)(COC1=CC=CC=C1C2CCCC2)O.C[C@](CNC(C)(C)C)(COC1=CC=CC=C1C2CCCC2)O.OS(=O)(=O)O

InChI

InChI=1S/2C19H31NO2.H2O4S/c2*1-18(2,3)20-13-19(4,21)14-22-17-12-8-7-11-16(17)15-9-5-6-10-15;1-5(2,3)4/h2*7-8,11-12,15,20-21H,5-6,9-10,13-14H2,1-4H3;(H2,1,2,3,4)/t2*19-;/m00./s1