4-(3-phenylmethoxypropyl)-3,5-bis(trifluoromethyl)-1,2,4-triazole

Systemtic Name: 4-(3-phenylmethoxypropyl)-3,5-bis(trifluoromethyl)-1,2,4-triazole Openeye Name: 4-(3-benzyloxypropyl)-3,5-bis(trifluoromethyl)-1,2,4-triazole CAS Name: 4-(3-phenylmethoxypropyl)-3,5-bis(trifluoromethyl)-1,2,4-triazole IUPAC Name: 4-(3-phenylmethoxypropyl)-3,5-bis(trifluoromethyl)-1,2,4-triazole Traditional Name: 4-(3-benzoxypropyl)-3,5-bis(trifluoromethyl)-1,2,4-triazole Formula: C14H13F6N3O MolecularWeight: 353.262939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCN2C(=NN=C2C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)COCCCN2C(=NN=C2C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C14H13F6N3O/c15-13(16,17)11-21-22-12(14(18,19)20)23(11)7-4-8-24-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2