(phenylmethyl) (2E)-2-(5-bromanyl-1H-pyridin-2-ylidene)-3-(2,4-dichlorophenyl)-3-oxidanylidene-propanoate

Systemtic Name: (phenylmethyl) (2E)-2-(5-bromanyl-1H-pyridin-2-ylidene)-3-(2,4-dichlorophenyl)-3-oxidanylidene-propanoate Openeye Name: benzyl (2E)-2-(5-bromo-1H-pyridin-2-ylidene)-3-(2,4-dichlorophenyl)-3-oxo-propanoate CAS Name: (2E)-2-(5-bromo-1H-pyridin-2-ylidene)-3-(2,4-dichlorophenyl)-3-oxopropanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2E)-2-(5-bromo-1H-pyridin-2-ylidene)-3-(2,4-dichlorophenyl)-3-oxopropanoate Traditional Name: (2E)-2-(5-bromo-1H-pyridin-2-ylidene)-3-(2,4-dichlorophenyl)-3-keto-propionic acid benzyl ester Formula: C21H14BrCl2NO3 MolecularWeight: 479.15076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=C2C=CC(=CN2)Br)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)/C(=C/2\C=CC(=CN2)Br)/C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H14BrCl2NO3/c22-14-6-9-18(25-11-14)19(20(26)16-8-7-15(23)10-17(16)24)21(27)28-12-13-4-2-1-3-5-13/h1-11,25H,12H2/b19-18+