[3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2,6-dimethoxyphenyl)methanone

Systemtic Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2,6-dimethoxyphenyl)methanone Openeye Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2,6-dimethoxyphenyl)methanone CAS Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2,6-dimethoxyphenyl)methanone IUPAC Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2,6-dimethoxyphenyl)methanone Traditional Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2,6-dimethoxyphenyl)methanone Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C25H31N3O4/c1-7-8-16-32-24-26-22(17-12-14-18(15-13-17)25(2,3)4)28(27-24)23(29)21-19(30-5)10-9-11-20(21)31-6/h9-15H,7-8,16H2,1-6H3