2-[4-(4-methoxy-3-propan-2-yl-phenoxy)-3,5-dimethyl-phenyl]-1H-1,2,4-triazol-3-one

Systemtic Name: 2-[4-(4-methoxy-3-propan-2-yl-phenoxy)-3,5-dimethyl-phenyl]-1H-1,2,4-triazol-3-one Openeye Name: 2-[4-(3-isopropyl-4-methoxy-phenoxy)-3,5-dimethyl-phenyl]-1H-1,2,4-triazol-3-one CAS Name: 2-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]-1H-1,2,4-triazol-3-one IUPAC Name: 2-[4-(4-methoxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]-1H-1,2,4-triazol-3-one Traditional Name: 2-[4-(3-isopropyl-4-methoxy-phenoxy)-3,5-dimethyl-phenyl]-1H-1,2,4-triazol-3-one Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)OC)C(C)C)C)N3C(=O)N=CN3

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)OC)C(C)C)C)N3C(=O)N=CN3

InChI

InChI=1S/C20H23N3O3/c1-12(2)17-10-16(6-7-18(17)25-5)26-19-13(3)8-15(9-14(19)4)23-20(24)21-11-22-23/h6-12H,1-5H3,(H,21,22,24)