cobalt(2+); 6-[6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)piperidin-1-id-2-yl]-2H-pyridin-1-ide; dihydrate

Systemtic Name: cobalt(2+); 6-[6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)piperidin-1-id-2-yl]-2H-pyridin-1-ide; dihydrate Openeye Name: cobaltous 6-[6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)piperidin-1-id-2-yl]-2H-pyridin-1-ide dihydrate CAS Name: cobalt(2+); 6-[6-[6-(2-piperidin-1-idyl)-2-piperidin-1-idyl]-2-piperidin-1-idyl]-2H-pyridin-1-ide; dihydrate IUPAC Name: cobalt(2+); 6-[6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)piperidin-1-id-2-yl]-2H-pyridin-1-ide; dihydrate Traditional Name: cobaltous 6-[6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)piperidin-1-id-2-yl]-2H-pyridin-1-ide dihydrate Formula: C20H34CoN4O2-2 MolecularWeight: 421.44276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[N-]C(C1)C2CCCC([N-]2)C3CCCC([N-]3)C4=CC=CC[N-]4.O.O.[Co+2]

Isomeric SMILES

C1CC[N-]C(C1)C2CCCC([N-]2)C3CCCC([N-]3)C4=CC=CC[N-]4.O.O.[Co+2]

InChI

InChI=1S/C20H30N4.Co.2H2O/c1-3-13-21-15(7-1)17-9-5-11-19(23-17)20-12-6-10-18(24-20)16-8-2-4-14-22-16;;;/h1,3,7,16-20H,2,4-6,8-14H2;;2*1H2/q-4;+2;;