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

Systemtic Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone Openeye Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone CAS Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone IUPAC Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone Traditional Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone Formula: C26H31N3O2 MolecularWeight: 417.54324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3CC3C4=CC=CC=C4

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3CC3C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2/c1-5-6-16-31-25-27-23(19-12-14-20(15-13-19)26(2,3)4)29(28-25)24(30)22-17-21(22)18-10-8-7-9-11-18/h7-15,21-22H,5-6,16-17H2,1-4H3