(4E)-4-[2-(3-nitrophenyl)-1H-pyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-[2-(3-nitrophenyl)-1H-pyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-3-hydroxy-4-[2-(3-nitrophenyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4E)-3-hydroxy-4-[2-(3-nitrophenyl)-1H-pyrazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-3-hydroxy-4-[2-(3-nitrophenyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-3-hydroxy-4-[2-(3-nitrophenyl)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C15H11N3O4 MolecularWeight: 297.26554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=C3C=CC(=O)C=C3O)C=CN2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2/C(=C/3\C=CC(=O)C=C3O)/C=CN2

InChI

InChI=1S/C15H11N3O4/c19-12-4-5-13(15(20)9-12)14-6-7-16-17(14)10-2-1-3-11(8-10)18(21)22/h1-9,16,20H/b14-13+