phenyl-[1-[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylpiperidin-4-yl]methanone

Systemtic Name: phenyl-[1-[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylpiperidin-4-yl]methanone Openeye Name: phenyl-[1-[4-(1,2,4-triazol-1-ylmethyl)benzoyl]-4-piperidyl]methanone CAS Name: [1-[oxo-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-4-piperidinyl]-phenylmethanone IUPAC Name: phenyl-[1-[4-(1,2,4-triazol-1-ylmethyl)benzoyl]piperidin-4-yl]methanone Traditional Name: phenyl-[1-[4-(1,2,4-triazol-1-ylmethyl)benzoyl]-4-piperidyl]methanone Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C22H22N4O2/c27-21(18-4-2-1-3-5-18)19-10-12-25(13-11-19)22(28)20-8-6-17(7-9-20)14-26-16-23-15-24-26/h1-9,15-16,19H,10-14H2