(5E)-5-[azanyl(oxidanyl)methylidene]-3-but-3-enyl-1H-pyrazol-4-one

Systemtic Name: (5E)-5-[azanyl(oxidanyl)methylidene]-3-but-3-enyl-1H-pyrazol-4-one Openeye Name: (5E)-5-[amino(hydroxy)methylene]-3-but-3-enyl-1H-pyrazol-4-one CAS Name: (5E)-5-[amino(hydroxy)methylidene]-3-but-3-enyl-1H-pyrazol-4-one IUPAC Name: (5E)-5-[amino(hydroxy)methylidene]-3-but-3-enyl-1H-pyrazol-4-one Traditional Name: (3E)-3-[amino(hydroxy)methylene]-5-but-3-enyl-2-pyrazolin-4-one Formula: C8H11N3O2 MolecularWeight: 181.19184

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC1=NNC(=C(N)O)C1=O

Isomeric SMILES

C=CCCC1=NN/C(=C(\N)/O)/C1=O

InChI

InChI=1S/C8H11N3O2/c1-2-3-4-5-7(12)6(8(9)13)11-10-5/h2,11,13H,1,3-4,9H2/b8-6+