bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-1-ium-2-yl]methanol

Systemtic Name: bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-1-ium-2-yl]methanol Openeye Name: bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-1-ium-2-yl]methanol CAS Name: bis(4-tert-butylphenyl)-[(2S)-2-pyrrolidin-1-iumyl]methanol IUPAC Name: bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-1-ium-2-yl]methanol Traditional Name: bis(4-tert-butylphenyl)-[(2S)-pyrrolidin-1-ium-2-yl]methanol Formula: C25H36NO+ MolecularWeight: 366.55944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C2CCC[NH2+]2)(C3=CC=C(C=C3)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C([C@@H]2CCC[NH2+]2)(C3=CC=C(C=C3)C(C)(C)C)O

InChI

InChI=1S/C25H35NO/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/h9-16,22,26-27H,7-8,17H2,1-6H3/p+1/t22-/m0/s1