5-chloranyl-2-(phenylmethyl)-1H-pyrazol-3-one

Systemtic Name: 5-chloranyl-2-(phenylmethyl)-1H-pyrazol-3-one Openeye Name: 2-benzyl-5-chloro-1H-pyrazol-3-one CAS Name: 5-chloro-2-(phenylmethyl)-1H-pyrazol-3-one IUPAC Name: 2-benzyl-5-chloro-1H-pyrazol-3-one Traditional Name: 2-benzyl-5-chloro-3-pyrazolin-3-one Formula: C10H9ClN2O MolecularWeight: 208.64426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C=C(N2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C=C(N2)Cl

InChI

InChI=1S/C10H9ClN2O/c11-9-6-10(14)13(12-9)7-8-4-2-1-3-5-8/h1-6,12H,7H2