2-[5-[(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]furan-2-yl]-4-nitro-phenolate

Systemtic Name: 2-[5-[(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]furan-2-yl]-4-nitro-phenolate Openeye Name: 2-[5-[(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-furyl]-4-nitro-phenolate CAS Name: 2-[5-[(3-methylene-5-oxo-1-phenyl-4-pyrazolidinylidene)methyl]-2-furanyl]-4-nitrophenolate IUPAC Name: 2-[5-[(3-methylidene-5-oxo-1-phenylpyrazolidin-4-ylidene)methyl]furan-2-yl]-4-nitrophenolate Traditional Name: 2-[5-[(5-keto-3-methylene-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-furyl]-4-nitro-phenolate Formula: C21H14N3O5- MolecularWeight: 388.35296

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(=CC2=CC=C(O2)C3=C(C=CC(=C3)[N+](=O)[O-])[O-])C(=O)N(N1)C4=CC=CC=C4

Isomeric SMILES

C=C1C(=CC2=CC=C(O2)C3=C(C=CC(=C3)[N+](=O)[O-])[O-])C(=O)N(N1)C4=CC=CC=C4

InChI

InChI=1S/C21H15N3O5/c1-13-17(21(26)23(22-13)14-5-3-2-4-6-14)12-16-8-10-20(29-16)18-11-15(24(27)28)7-9-19(18)25/h2-12,22,25H,1H2/p-1