2,5-dimethyl-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-one

Systemtic Name: 2,5-dimethyl-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-one Openeye Name: 4-(4-benzyloxyphenyl)-2,5-dimethyl-1,2,4-triazol-3-one CAS Name: 2,5-dimethyl-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-one IUPAC Name: 2,5-dimethyl-4-(4-phenylmethoxyphenyl)-1,2,4-triazol-3-one Traditional Name: 4-(4-benzoxyphenyl)-2,5-dimethyl-1,2,4-triazol-3-one Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C(=O)N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C

InChI

InChI=1S/C17H17N3O2/c1-13-18-19(2)17(21)20(13)15-8-10-16(11-9-15)22-12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3