2-phenyl-5-(piperidin-1-ylmethyl)-1H-1,2,4-triazol-3-one

Systemtic Name: 2-phenyl-5-(piperidin-1-ylmethyl)-1H-1,2,4-triazol-3-one Openeye Name: 2-phenyl-5-(1-piperidylmethyl)-1H-1,2,4-triazol-3-one CAS Name: 2-phenyl-5-(1-piperidinylmethyl)-1H-1,2,4-triazol-3-one IUPAC Name: 2-phenyl-5-(piperidin-1-ylmethyl)-1H-1,2,4-triazol-3-one Traditional Name: 2-phenyl-5-(piperidinomethyl)-1H-1,2,4-triazol-3-one Formula: C14H18N4O MolecularWeight: 258.31892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=NC(=O)N(N2)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)CC2=NC(=O)N(N2)C3=CC=CC=C3

InChI

InChI=1S/C14H18N4O/c19-14-15-13(11-17-9-5-2-6-10-17)16-18(14)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,15,16,19)