methyl (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methylidene-pentanoate

Systemtic Name: methyl (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methylidene-pentanoate Openeye Name: methyl (2S)-2-(1,3-dioxoisoindolin-2-yl)-3-methylene-pentanoate CAS Name: (2S)-2-(1,3-dioxo-2-isoindolyl)-3-methylenepentanoic acid methyl ester IUPAC Name: methyl (2S)-2-(1,3-dioxoisoindol-2-yl)-3-methylidenepentanoate Traditional Name: (2S)-3-ethyl-2-phthalimido-but-3-enoic acid methyl ester Formula: C15H15NO4 MolecularWeight: 273.2839

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)C(C(=O)OC)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

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

InChI

InChI=1S/C15H15NO4/c1-4-9(2)12(15(19)20-3)16-13(17)10-7-5-6-8-11(10)14(16)18/h5-8,12H,2,4H2,1,3H3/t12-/m0/s1