azanyl (2E)-2-[(3-nitrophenyl)methylidene]-3,5-bis(oxidanylidene)hexanoate

Systemtic Name: azanyl (2E)-2-[(3-nitrophenyl)methylidene]-3,5-bis(oxidanylidene)hexanoate Openeye Name: amino (2E)-2-[(3-nitrophenyl)methylene]-3,5-dioxo-hexanoate CAS Name: (2E)-2-[(3-nitrophenyl)methylidene]-3,5-dioxohexanoic acid amino ester IUPAC Name: amino (2E)-2-[(3-nitrophenyl)methylidene]-3,5-dioxohexanoate Traditional Name: (E)-2-acetoacetyl-3-(3-nitrophenyl)acrylic acid amino ester Formula: C13H12N2O6 MolecularWeight: 292.24418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)ON

Isomeric SMILES

CC(=O)CC(=O)/C(=C\C1=CC(=CC=C1)[N+](=O)[O-])/C(=O)ON

InChI

InChI=1S/C13H12N2O6/c1-8(16)5-12(17)11(13(18)21-14)7-9-3-2-4-10(6-9)15(19)20/h2-4,6-7H,5,14H2,1H3/b11-7+