4-(aminomethyl)-N-cycloheptyl-pyridin-3-amine hydrate dihydrochloride

Systemtic Name: 4-(aminomethyl)-N-cycloheptyl-pyridin-3-amine hydrate dihydrochloride Openeye Name: 4-(aminomethyl)-N-cycloheptyl-pyridin-3-amine hydrate dihydrochloride CAS Name: 4-(aminomethyl)-N-cycloheptyl-3-pyridinamine hydrate dihydrochloride IUPAC Name: 4-(aminomethyl)-N-cycloheptylpyridin-3-amine hydrate dihydrochloride Traditional Name: [4-(aminomethyl)-3-pyridyl]-cycloheptyl-amine hydrate dihydrochloride Formula: C13H25Cl2N3O MolecularWeight: 310.2631

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=C(C=CN=C2)CN.O.Cl.Cl

Isomeric SMILES

C1CCCC(CC1)NC2=C(C=CN=C2)CN.O.Cl.Cl

InChI

InChI=1S/C13H21N3.2ClH.H2O/c14-9-11-7-8-15-10-13(11)16-12-5-3-1-2-4-6-12;;;/h7-8,10,12,16H,1-6,9,14H2;2*1H;1H2