methyl 2-[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-ethoxy-6-nitro-phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-ethoxy-6-nitro-phenoxy]ethanoate Openeye Name: methyl 2-[4-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-ethoxy-6-nitro-phenoxy]acetate CAS Name: 2-[4-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-2-ethoxy-6-nitrophenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-ethoxy-6-nitrophenoxy]acetate Traditional Name: 2-[4-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-ethoxy-6-nitro-phenoxy]acetic acid methyl ester Formula: C21H19N3O8 MolecularWeight: 441.39086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC(=O)OC)[N+](=O)[O-])C=C2C(=O)NN(C2=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC(=O)OC)[N+](=O)[O-])C=C2C(=O)NN(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O8/c1-3-31-17-11-13(10-16(24(28)29)19(17)32-12-18(25)30-2)9-15-20(26)22-23(21(15)27)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3,(H,22,26)