2-[(2E)-2-[1-ethoxy-1,3-bis(oxidanylidene)butan-2-ylidene]hydrazinyl]-4-nitro-phenolate

Systemtic Name: 2-[(2E)-2-[1-ethoxy-1,3-bis(oxidanylidene)butan-2-ylidene]hydrazinyl]-4-nitro-phenolate Openeye Name: 2-[(2E)-2-(1-ethoxycarbonyl-2-oxo-propylidene)hydrazino]-4-nitro-phenolate CAS Name: 2-[(2E)-2-(1-ethoxy-1,3-dioxobutan-2-ylidene)hydrazinyl]-4-nitrophenolate IUPAC Name: 2-[(2E)-2-(1-ethoxy-1,3-dioxobutan-2-ylidene)hydrazinyl]-4-nitrophenolate Traditional Name: 2-[(N'E)-N'-(1-carbethoxy-2-keto-propylidene)hydrazino]-4-nitro-phenolate Formula: C12H12N3O6- MolecularWeight: 294.24018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NNC1=C(C=CC(=C1)[N+](=O)[O-])[O-])C(=O)C

Isomeric SMILES

CCOC(=O)/C(=N/NC1=C(C=CC(=C1)[N+](=O)[O-])[O-])/C(=O)C

InChI

InChI=1S/C12H13N3O6/c1-3-21-12(18)11(7(2)16)14-13-9-6-8(15(19)20)4-5-10(9)17/h4-6,13,17H,3H2,1-2H3/p-1/b14-11+