2-[2-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]ethyl]guanidine; sulfuric acid

Systemtic Name: 2-[2-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]ethyl]guanidine; sulfuric acid Openeye Name: 2-[2-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]ethyl]guanidine; sulfuric acid CAS Name: 2-[2-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]ethyl]guanidine; sulfuric acid IUPAC Name: 2-[2-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]ethyl]guanidine; sulfuric acid Traditional Name: 2-[2-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]ethyl]guanidine; sulfuric acid Formula: C22H46N8O4S MolecularWeight: 518.71684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(CC2C1)CCN=C(N)N.C1CCC2CN(CC2C1)CCN=C(N)N.OS(=O)(=O)O

Isomeric SMILES

C1CC[C@H]2CN(C[C@H]2C1)CCN=C(N)N.C1CC[C@H]2CN(C[C@H]2C1)CCN=C(N)N.OS(=O)(=O)O

InChI

InChI=1S/2C11H22N4.H2O4S/c2*12-11(13)14-5-6-15-7-9-3-1-2-4-10(9)8-15;1-5(2,3)4/h2*9-10H,1-8H2,(H4,12,13,14);(H2,1,2,3,4)/t2*9-,10+;