1,1-dicyclopentyl-6-pyridin-2-yl-2H-pyridin-1-ium-5-carboximidamide dihydrochloride

Systemtic Name: 1,1-dicyclopentyl-6-pyridin-2-yl-2H-pyridin-1-ium-5-carboximidamide dihydrochloride Openeye Name: 1,1-dicyclopentyl-6-(2-pyridyl)-2H-pyridin-1-ium-5-carboxamidine dihydrochloride CAS Name: 1,1-dicyclopentyl-6-(2-pyridinyl)-2H-pyridin-1-ium-5-carboximidamide dihydrochloride IUPAC Name: 1,1-dicyclopentyl-6-pyridin-2-yl-2H-pyridin-1-ium-5-carboximidamide dihydrochloride Traditional Name: 1,1-dicyclopentyl-6-(2-pyridyl)-2H-pyridin-1-ium-5-carboxamidine dihydrochloride Formula: C21H31Cl2N4+ MolecularWeight: 410.40364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[N+]2(CC=CC(=C2C3=CC=CC=N3)C(=N)N)C4CCCC4.Cl.Cl

Isomeric SMILES

C1CCC(C1)[N+]2(CC=CC(=C2C3=CC=CC=N3)C(=N)N)C4CCCC4.Cl.Cl

InChI

InChI=1S/C21H29N4.2ClH/c22-21(23)18-12-7-15-25(16-8-1-2-9-16,17-10-3-4-11-17)20(18)19-13-5-6-14-24-19;;/h5-7,12-14,16-17H,1-4,8-11,15H2,(H3,22,23);2*1H/q+1;;