3,3-di(imidazol-1-yl)-1-(4-methylphenyl)prop-2-en-1-one

Systemtic Name: 3,3-di(imidazol-1-yl)-1-(4-methylphenyl)prop-2-en-1-one Openeye Name: 3,3-di(imidazol-1-yl)-1-(p-tolyl)prop-2-en-1-one CAS Name: 3,3-bis(1-imidazolyl)-1-(4-methylphenyl)-2-propen-1-one IUPAC Name: 3,3-di(imidazol-1-yl)-1-(4-methylphenyl)prop-2-en-1-one Traditional Name: 3,3-di(imidazol-1-yl)-1-(p-tolyl)prop-2-en-1-one Formula: C16H14N4O MolecularWeight: 278.30856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C(N2C=CN=C2)N3C=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C=C(N2C=CN=C2)N3C=CN=C3

InChI

InChI=1S/C16H14N4O/c1-13-2-4-14(5-3-13)15(21)10-16(19-8-6-17-11-19)20-9-7-18-12-20/h2-12H,1H3