dimethyl (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-bromanyl-pentanedioate

Systemtic Name: dimethyl (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-bromanyl-pentanedioate Openeye Name: dimethyl (4S)-2-bromo-4-(1,3-dioxoisoindolin-2-yl)pentanedioate CAS Name: (4S)-2-bromo-4-(1,3-dioxo-2-isoindolyl)pentanedioic acid dimethyl ester IUPAC Name: dimethyl (4S)-2-bromo-4-(1,3-dioxoisoindol-2-yl)pentanedioate Traditional Name: (4S)-2-bromo-4-phthalimido-glutaric acid dimethyl ester Formula: C15H14BrNO6 MolecularWeight: 384.17876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(C(=O)OC)Br)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

COC(=O)[C@H](CC(C(=O)OC)Br)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C15H14BrNO6/c1-22-14(20)10(16)7-11(15(21)23-2)17-12(18)8-5-3-4-6-9(8)13(17)19/h3-6,10-11H,7H2,1-2H3/t10?,11-/m0/s1