4-[(1S)-1-azanylbutyl]-N-pyridin-4-yl-cyclohexane-1-carboxamide dihydrochloride

Systemtic Name: 4-[(1S)-1-azanylbutyl]-N-pyridin-4-yl-cyclohexane-1-carboxamide dihydrochloride Openeye Name: 4-[(1S)-1-aminobutyl]-N-(4-pyridyl)cyclohexanecarboxamide dihydrochloride CAS Name: 4-[(1S)-1-aminobutyl]-N-pyridin-4-yl-1-cyclohexanecarboxamide dihydrochloride IUPAC Name: 4-[(1S)-1-aminobutyl]-N-pyridin-4-ylcyclohexane-1-carboxamide dihydrochloride Traditional Name: 4-[(1S)-1-aminobutyl]-N-(4-pyridyl)cyclohexanecarboxamide dihydrochloride Formula: C16H27Cl2N3O MolecularWeight: 348.31108

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCC(CC1)C(=O)NC2=CC=NC=C2)N.Cl.Cl

Isomeric SMILES

CCC[C@@H](C1CCC(CC1)C(=O)NC2=CC=NC=C2)N.Cl.Cl

InChI

InChI=1S/C16H25N3O.2ClH/c1-2-3-15(17)12-4-6-13(7-5-12)16(20)19-14-8-10-18-11-9-14;;/h8-13,15H,2-7,17H2,1H3,(H,18,19,20);2*1H/t12?,13?,15-;;/m0../s1