bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-2-yl]methanol; sulfuric acid

Systemtic Name: bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-2-yl]methanol; sulfuric acid Openeye Name: bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-2-yl]methanol; sulfuric acid CAS Name: bis(4-tert-butylphenyl)-[(2S)-2-pyrrolidinyl]methanol; sulfuric acid IUPAC Name: bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-2-yl]methanol; sulfuric acid Traditional Name: bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-2-yl]methanol; sulfuric acid Formula: C25H37NO5S MolecularWeight: 463.62998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C2CCCN2)(C3=CC=C(C=C3)C(C)(C)C)O.OS(=O)(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C([C@@H]2CCCN2)(C3=CC=C(C=C3)C(C)(C)C)O.OS(=O)(=O)O

InChI

InChI=1S/C25H35NO.H2O4S/c1-23(2,3)18-9-13-20(14-10-18)25(27,22-8-7-17-26-22)21-15-11-19(12-16-21)24(4,5)6;1-5(2,3)4/h9-16,22,26-27H,7-8,17H2,1-6H3;(H2,1,2,3,4)/t22-;/m0./s1