2-[2-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-4-bromanyl-6-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-4-bromanyl-6-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-bromo-2-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-6-methoxy-phenoxy]acetic acid CAS Name: 2-[4-bromo-2-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-6-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-bromo-2-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-6-methoxyphenoxy]acetic acid Traditional Name: 2-[4-bromo-2-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-6-methoxy-phenoxy]acetic acid Formula: C19H15BrN2O6 MolecularWeight: 447.2362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC(=O)O

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC(=O)O

InChI

InChI=1S/C19H15BrN2O6/c1-27-15-9-12(20)7-11(17(15)28-10-16(23)24)8-14-18(25)21-22(19(14)26)13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,21,25)(H,23,24)