3-[(E)-C-(phenylmethoxymethyl)-N-(1H-pyrazol-5-yl)carbonimidoyl]oxolan-2-one

Systemtic Name: 3-[(E)-C-(phenylmethoxymethyl)-N-(1H-pyrazol-5-yl)carbonimidoyl]oxolan-2-one Openeye Name: 3-[(E)-C-(benzyloxymethyl)-N-(1H-pyrazol-5-yl)carbonimidoyl]tetrahydrofuran-2-one CAS Name: 3-[(1E)-2-phenylmethoxy-1-(1H-pyrazol-5-ylimino)ethyl]-2-oxolanone IUPAC Name: 3-[(E)-C-(phenylmethoxymethyl)-N-(1H-pyrazol-5-yl)carbonimidoyl]oxolan-2-one Traditional Name: 3-[(E)-C-(benzoxymethyl)-N-(1H-pyrazol-5-yl)carbonimidoyl]tetrahydrofuran-2-one Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1C(=NC2=CC=NN2)COCC3=CC=CC=C3

Isomeric SMILES

C1COC(=O)C1/C(=N\C2=CC=NN2)/COCC3=CC=CC=C3

InChI

InChI=1S/C16H17N3O3/c20-16-13(7-9-22-16)14(18-15-6-8-17-19-15)11-21-10-12-4-2-1-3-5-12/h1-6,8,13H,7,9-11H2,(H,17,19)/b18-14-