2-[N-[2-(1H-imidazol-5-yl)ethyl]-C-methyl-carbonimidoyl]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[N-[2-(1H-imidazol-5-yl)ethyl]-C-methyl-carbonimidoyl]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[N-[2-(1H-imidazol-5-yl)ethyl]-C-methyl-carbonimidoyl]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[1-[2-(1H-imidazol-5-yl)ethylimino]ethyl]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[N-[2-(1H-imidazol-5-yl)ethyl]-C-methylcarbonimidoyl]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[N-[2-(1H-imidazol-5-yl)ethyl]-C-methyl-carbonimidoyl]-5-phenyl-cyclohexane-1,3-quinone Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCC1=CN=CN1)C2C(=O)CC(CC2=O)C3=CC=CC=C3

Isomeric SMILES

CC(=NCCC1=CN=CN1)C2C(=O)CC(CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2/c1-13(21-8-7-16-11-20-12-22-16)19-17(23)9-15(10-18(19)24)14-5-3-2-4-6-14/h2-6,11-12,15,19H,7-10H2,1H3,(H,20,22)