4-[(2-hydroxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one

Systemtic Name: 4-[(2-hydroxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Openeye Name: 4-[(2-hydroxyethylamino)methylene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one CAS Name: 4-[(2-hydroxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)-3-pyrazolone IUPAC Name: 4-[(2-hydroxyethylamino)methylidene]-5-methyl-2-(4-nitrophenyl)pyrazol-3-one Traditional Name: 4-[(2-hydroxyethylamino)methylene]-5-methyl-2-(4-nitrophenyl)-2-pyrazolin-3-one Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNCCO)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C1=CNCCO)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4/c1-9-12(8-14-6-7-18)13(19)16(15-9)10-2-4-11(5-3-10)17(20)21/h2-5,8,14,18H,6-7H2,1H3