[1-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]-1,2,4-triazol-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [1-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]-1,2,4-triazol-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[1-(3,5-dichloro-4-hydroxy-phenyl)-1,2,4-triazol-3-yl]methanone CAS Name: [1-(3,5-dichloro-4-hydroxyphenyl)-1,2,4-triazol-3-yl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[1-(3,5-dichloro-4-hydroxyphenyl)-1,2,4-triazol-3-yl]methanone Traditional Name: (4-benzylpiperidino)-[1-(3,5-dichloro-4-hydroxy-phenyl)-1,2,4-triazol-3-yl]methanone Formula: C21H20Cl2N4O2 MolecularWeight: 431.3151

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NN(C=N3)C4=CC(=C(C(=C4)Cl)O)Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=NN(C=N3)C4=CC(=C(C(=C4)Cl)O)Cl

InChI

InChI=1S/C21H20Cl2N4O2/c22-17-11-16(12-18(23)19(17)28)27-13-24-20(25-27)21(29)26-8-6-15(7-9-26)10-14-4-2-1-3-5-14/h1-5,11-13,15,28H,6-10H2