piperidin-1-yl-[4-(1,2,4-triazol-1-yl)phenyl]methanone dihydrochloride

Systemtic Name: piperidin-1-yl-[4-(1,2,4-triazol-1-yl)phenyl]methanone dihydrochloride Openeye Name: 1-piperidyl-[4-(1,2,4-triazol-1-yl)phenyl]methanone dihydrochloride CAS Name: 1-piperidinyl-[4-(1,2,4-triazol-1-yl)phenyl]methanone dihydrochloride IUPAC Name: piperidin-1-yl-[4-(1,2,4-triazol-1-yl)phenyl]methanone dihydrochloride Traditional Name: piperidino-[4-(1,2,4-triazol-1-yl)phenyl]methanone dihydrochloride Formula: C14H18Cl2N4O MolecularWeight: 329.22492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C=NC=N3.Cl.Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)N3C=NC=N3.Cl.Cl

InChI

InChI=1S/C14H16N4O.2ClH/c19-14(17-8-2-1-3-9-17)12-4-6-13(7-5-12)18-11-15-10-16-18;;/h4-7,10-11H,1-3,8-9H2;2*1H