(2-oxidanylidene-2-phenylazanyl-ethyl) 2-[4,5,6,7-tetrakis(bromanyl)-1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-[4,5,6,7-tetrakis(bromanyl)-1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-(4,5,6,7-tetrabromo-1,3-dioxo-isoindolin-2-yl)propanoate CAS Name: 2-(4,5,6,7-tetrabromo-1,3-dioxo-2-isoindolyl)propanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-(4,5,6,7-tetrabromo-1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 2-(4,5,6,7-tetrabromo-1,3-diketo-isoindolin-2-yl)propionic acid (2-anilino-2-keto-ethyl) ester Formula: C19H12Br4N2O5 MolecularWeight: 667.92498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC=CC=C1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Br)Br)Br)Br

Isomeric SMILES

CC(C(=O)OCC(=O)NC1=CC=CC=C1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Br)Br)Br)Br

InChI

InChI=1S/C19H12Br4N2O5/c1-8(19(29)30-7-10(26)24-9-5-3-2-4-6-9)25-17(27)11-12(18(25)28)14(21)16(23)15(22)13(11)20/h2-6,8H,7H2,1H3,(H,24,26)