5-(2,6-dimethylphenyl)-1-(1H-imidazol-5-yl)pentan-1-one

Systemtic Name: 5-(2,6-dimethylphenyl)-1-(1H-imidazol-5-yl)pentan-1-one Openeye Name: 5-(2,6-dimethylphenyl)-1-(1H-imidazol-5-yl)pentan-1-one CAS Name: 5-(2,6-dimethylphenyl)-1-(1H-imidazol-5-yl)-1-pentanone IUPAC Name: 5-(2,6-dimethylphenyl)-1-(1H-imidazol-5-yl)pentan-1-one Traditional Name: 5-(2,6-dimethylphenyl)-1-(1H-imidazol-5-yl)pentan-1-one Formula: C16H20N2O MolecularWeight: 256.3428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)CCCCC(=O)C2=CN=CN2

Isomeric SMILES

CC1=C(C(=CC=C1)C)CCCCC(=O)C2=CN=CN2

InChI

InChI=1S/C16H20N2O/c1-12-6-5-7-13(2)14(12)8-3-4-9-16(19)15-10-17-11-18-15/h5-7,10-11H,3-4,8-9H2,1-2H3,(H,17,18)