(4S)-4-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanoic acid

Systemtic Name: (4S)-4-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanoic acid Openeye Name: (4S)-4-(1,3-dioxoisoindolin-2-yl)pentanoic acid CAS Name: (4S)-4-(1,3-dioxo-2-isoindolyl)pentanoic acid IUPAC Name: (4S)-4-(1,3-dioxoisoindol-2-yl)pentanoic acid Traditional Name: (4S)-4-phthalimidovaleric acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO4/c1-8(6-7-11(15)16)14-12(17)9-4-2-3-5-10(9)13(14)18/h2-5,8H,6-7H2,1H3,(H,15,16)/t8-/m0/s1