1-imidazol-1-yl-4-(3-methylphenyl)butan-2-one

Systemtic Name: 1-imidazol-1-yl-4-(3-methylphenyl)butan-2-one Openeye Name: 1-imidazol-1-yl-4-(m-tolyl)butan-2-one CAS Name: 1-(1-imidazolyl)-4-(3-methylphenyl)-2-butanone IUPAC Name: 1-imidazol-1-yl-4-(3-methylphenyl)butan-2-one Traditional Name: 1-imidazol-1-yl-4-(m-tolyl)butan-2-one Formula: C14H16N2O MolecularWeight: 228.28964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCC(=O)CN2C=CN=C2

Isomeric SMILES

CC1=CC(=CC=C1)CCC(=O)CN2C=CN=C2

InChI

InChI=1S/C14H16N2O/c1-12-3-2-4-13(9-12)5-6-14(17)10-16-8-7-15-11-16/h2-4,7-9,11H,5-6,10H2,1H3