[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-cyclohexyl-methanone

Systemtic Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-cyclohexyl-methanone Openeye Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-cyclohexyl-methanone CAS Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-cyclohexylmethanone IUPAC Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-cyclohexylmethanone Traditional Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-cyclohexyl-methanone Formula: C21H29N3O2 MolecularWeight: 355.47386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)CC)C(=O)C3CCCCC3

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)CC)C(=O)C3CCCCC3

InChI

InChI=1S/C21H29N3O2/c1-3-5-15-26-21-22-19(17-13-11-16(4-2)12-14-17)24(23-21)20(25)18-9-7-6-8-10-18/h11-14,18H,3-10,15H2,1-2H3