(3S)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-2-oxidanylidene-pentanal

Systemtic Name: (3S)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-2-oxidanylidene-pentanal Openeye Name: (3S)-3-(1,3-dioxoisoindolin-2-yl)-4-methyl-2-oxo-pentanal CAS Name: (3S)-3-(1,3-dioxo-2-isoindolyl)-4-methyl-2-oxopentanal IUPAC Name: (3S)-3-(1,3-dioxoisoindol-2-yl)-4-methyl-2-oxopentanal Traditional Name: (3S)-2-keto-4-methyl-3-phthalimido-valeraldehyde Formula: C14H13NO4 MolecularWeight: 259.25732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO4/c1-8(2)12(11(17)7-16)15-13(18)9-5-3-4-6-10(9)14(15)19/h3-8,12H,1-2H3/t12-/m0/s1