1-(1-phenylpyrazol-4-yl)pentane-1,4-dione

Systemtic Name: 1-(1-phenylpyrazol-4-yl)pentane-1,4-dione Openeye Name: 1-(1-phenylpyrazol-4-yl)pentane-1,4-dione CAS Name: 1-(1-phenyl-4-pyrazolyl)pentane-1,4-dione IUPAC Name: 1-(1-phenylpyrazol-4-yl)pentane-1,4-dione Traditional Name: 1-(1-phenylpyrazol-4-yl)pentane-1,4-dione Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)C1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)CCC(=O)C1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O2/c1-11(17)7-8-14(18)12-9-15-16(10-12)13-5-3-2-4-6-13/h2-6,9-10H,7-8H2,1H3