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

Systemtic Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-cyclobutyl-methanone Openeye Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-cyclobutyl-methanone CAS Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-cyclobutylmethanone IUPAC Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-cyclobutylmethanone Traditional Name: [3-butoxy-5-(4-tert-butylphenyl)-1,2,4-triazol-1-yl]-cyclobutyl-methanone Formula: C21H29N3O2 MolecularWeight: 355.47386

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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)C3CCC3

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3CCC3

InChI

InChI=1S/C21H29N3O2/c1-5-6-14-26-20-22-18(24(23-20)19(25)16-8-7-9-16)15-10-12-17(13-11-15)21(2,3)4/h10-13,16H,5-9,14H2,1-4H3