(3,4-dimethylphenyl)-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]methanone

Systemtic Name: (3,4-dimethylphenyl)-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]methanone Openeye Name: (3,4-dimethylphenyl)-[3-(4-methyl-1,2,4-triazol-3-yl)-1-piperidyl]methanone CAS Name: (3,4-dimethylphenyl)-[3-(4-methyl-1,2,4-triazol-3-yl)-1-piperidinyl]methanone IUPAC Name: (3,4-dimethylphenyl)-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]methanone Traditional Name: (3,4-dimethylphenyl)-[3-(4-methyl-1,2,4-triazol-3-yl)piperidino]methanone Formula: C17H22N4O MolecularWeight: 298.38278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C3=NN=CN3C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C3=NN=CN3C)C

InChI

InChI=1S/C17H22N4O/c1-12-6-7-14(9-13(12)2)17(22)21-8-4-5-15(10-21)16-19-18-11-20(16)3/h6-7,9,11,15H,4-5,8,10H2,1-3H3