methyl (2S)-2-[[1,3-bis(oxidanylidene)isoindol-2-yl]carbonylamino]-5-bromanyl-4-oxidanylidene-pentanoate

Systemtic Name: methyl (2S)-2-[[1,3-bis(oxidanylidene)isoindol-2-yl]carbonylamino]-5-bromanyl-4-oxidanylidene-pentanoate Openeye Name: methyl (2S)-5-bromo-2-[(1,3-dioxoisoindoline-2-carbonyl)amino]-4-oxo-pentanoate CAS Name: (2S)-5-bromo-2-[[(1,3-dioxo-2-isoindolyl)-oxomethyl]amino]-4-oxopentanoic acid methyl ester IUPAC Name: methyl (2S)-5-bromo-2-[(1,3-dioxoisoindole-2-carbonyl)amino]-4-oxopentanoate Traditional Name: (2S)-5-bromo-2-[(1,3-diketoisoindoline-2-carbonyl)amino]-4-keto-valeric acid methyl ester Formula: C15H13BrN2O6 MolecularWeight: 397.17752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)CBr)NC(=O)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

COC(=O)[C@H](CC(=O)CBr)NC(=O)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C15H13BrN2O6/c1-24-14(22)11(6-8(19)7-16)17-15(23)18-12(20)9-4-2-3-5-10(9)13(18)21/h2-5,11H,6-7H2,1H3,(H,17,23)/t11-/m0/s1