4-[[[azanyl-(pyridin-2-ylamino)methylidene]amino]methyl]cyclohexane-1-carboxylate dihydrochloride

Systemtic Name: 4-[[[azanyl-(pyridin-2-ylamino)methylidene]amino]methyl]cyclohexane-1-carboxylate dihydrochloride Openeye Name: 4-[[[amino-(2-pyridylamino)methylene]amino]methyl]cyclohexanecarboxylate dihydrochloride CAS Name: 4-[[[amino-(2-pyridinylamino)methylidene]amino]methyl]-1-cyclohexanecarboxylate dihydrochloride IUPAC Name: 4-[[[amino-(pyridin-2-ylamino)methylidene]amino]methyl]cyclohexane-1-carboxylate dihydrochloride Traditional Name: 4-[[[amino-(2-pyridylamino)methylene]amino]methyl]cyclohexanecarboxylate dihydrochloride Formula: C14H21Cl2N4O2- MolecularWeight: 348.24814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN=C(N)NC2=CC=CC=N2)C(=O)[O-].Cl.Cl

Isomeric SMILES

C1CC(CCC1CN=C(N)NC2=CC=CC=N2)C(=O)[O-].Cl.Cl

InChI

InChI=1S/C14H20N4O2.2ClH/c15-14(18-12-3-1-2-8-16-12)17-9-10-4-6-11(7-5-10)13(19)20;;/h1-3,8,10-11H,4-7,9H2,(H,19,20)(H3,15,16,17,18);2*1H/p-1