N-[(2S,4R)-4-oxidanyl-1-phenylmethoxycarbonyl-pyrrolidin-2-yl]carbonylsulfamate; tetrabutylazanium

Systemtic Name: N-[(2S,4R)-4-oxidanyl-1-phenylmethoxycarbonyl-pyrrolidin-2-yl]carbonylsulfamate; tetrabutylazanium Openeye Name: N-[(2S,4R)-1-benzyloxycarbonyl-4-hydroxy-pyrrolidine-2-carbonyl]sulfamate; tetrabutylammonium CAS Name: N-[[(2S,4R)-4-hydroxy-1-phenylmethoxycarbonyl-2-pyrrolidinyl]-oxomethyl]sulfamate; tetrabutylammonium IUPAC Name: N-[(2S,4R)-4-hydroxy-1-phenylmethoxycarbonylpyrrolidine-2-carbonyl]sulfamate; tetrabutylazanium Traditional Name: N-[(2S,4R)-1-carbobenzoxy-4-hydroxy-prolyl]sulfamate; tetrabutylammonium Formula: C29H51N3O7S MolecularWeight: 585.79614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1C(CN(C1C(=O)NS(=O)(=O)[O-])C(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1[C@H](CN([C@@H]1C(=O)NS(=O)(=O)[O-])C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C16H36N.C13H16N2O7S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;16-10-6-11(12(17)14-23(19,20)21)15(7-10)13(18)22-8-9-4-2-1-3-5-9/h5-16H2,1-4H3;1-5,10-11,16H,6-8H2,(H,14,17)(H,19,20,21)/q+1;/p-1/t;10-,11+/m.1/s1