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

Systemtic Name: methyl 2-[2-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-4-bromanyl-6-methoxy-phenoxy]propanoate Openeye Name: methyl 2-[4-bromo-2-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-6-methoxy-phenoxy]propanoate CAS Name: 2-[4-bromo-2-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-6-methoxyphenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[4-bromo-2-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-6-methoxyphenoxy]propanoate Traditional Name: 2-[4-bromo-2-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-6-methoxy-phenoxy]propionic acid methyl ester Formula: C21H19BrN2O6 MolecularWeight: 475.28936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=C(C=C(C=C1C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OC

Isomeric SMILES

CC(C(=O)OC)OC1=C(C=C(C=C1C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OC

InChI

InChI=1S/C21H19BrN2O6/c1-12(21(27)29-3)30-18-13(9-14(22)11-17(18)28-2)10-16-19(25)23-24(20(16)26)15-7-5-4-6-8-15/h4-12H,1-3H3,(H,23,25)