5-(quinolin-2-ylmethyl)pyrazol-3-one

Systemtic Name: 5-(quinolin-2-ylmethyl)pyrazol-3-one Openeye Name: 5-(2-quinolylmethyl)pyrazol-3-one CAS Name: 5-(2-quinolinylmethyl)-3-pyrazolone IUPAC Name: 5-(quinolin-2-ylmethyl)pyrazol-3-one Traditional Name: 5-(2-quinolylmethyl)pyrazol-3-one Formula: C13H9N3O MolecularWeight: 223.23006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CC3=CC(=O)N=N3

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CC3=CC(=O)N=N3

InChI

InChI=1S/C13H9N3O/c17-13-8-11(15-16-13)7-10-6-5-9-3-1-2-4-12(9)14-10/h1-6,8H,7H2