2-[[1,3-bis(oxidanylidene)-2-[(1R)-1-phenylethyl]isoindol-5-yl]carbonylamino]-5-bromanyl-benzoate

Systemtic Name: 2-[[1,3-bis(oxidanylidene)-2-[(1R)-1-phenylethyl]isoindol-5-yl]carbonylamino]-5-bromanyl-benzoate Openeye Name: 5-bromo-2-[[1,3-dioxo-2-[(1R)-1-phenylethyl]isoindoline-5-carbonyl]amino]benzoate CAS Name: 5-bromo-2-[[[1,3-dioxo-2-[(1R)-1-phenylethyl]-5-isoindolyl]-oxomethyl]amino]benzoate IUPAC Name: 5-bromo-2-[[1,3-dioxo-2-[(1R)-1-phenylethyl]isoindole-5-carbonyl]amino]benzoate Traditional Name: 5-bromo-2-[[1,3-diketo-2-[(1R)-1-phenylethyl]isoindoline-5-carbonyl]amino]benzoate Formula: C24H16BrN2O5- MolecularWeight: 492.29824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=C(C=C4)Br)C(=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=C(C=C4)Br)C(=O)[O-]

InChI

InChI=1S/C24H17BrN2O5/c1-13(14-5-3-2-4-6-14)27-22(29)17-9-7-15(11-18(17)23(27)30)21(28)26-20-10-8-16(25)12-19(20)24(31)32/h2-13H,1H3,(H,26,28)(H,31,32)/p-1/t13-/m1/s1