(2S)-4-azanyl-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-(1,3-dioxoisoindolin-2-yl)-4-oxo-butanoate CAS Name: (2S)-4-amino-2-(1,3-dioxo-2-isoindolyl)-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-(1,3-dioxoisoindol-2-yl)-4-oxobutanoate Traditional Name: (2S)-4-amino-4-keto-2-phthalimido-butyrate Formula: C12H9N2O5- MolecularWeight: 261.21026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C(CC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)[C@@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C12H10N2O5/c13-9(15)5-8(12(18)19)14-10(16)6-3-1-2-4-7(6)11(14)17/h1-4,8H,5H2,(H2,13,15)(H,18,19)/p-1/t8-/m0/s1