5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-sulfanyl-pentanal

Systemtic Name: 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-sulfanyl-pentanal Openeye Name: 5-(1,3-dioxoisoindolin-2-yl)-2-sulfanyl-pentanal CAS Name: 5-(1,3-dioxo-2-isoindolyl)-2-mercaptopentanal IUPAC Name: 5-(1,3-dioxoisoindol-2-yl)-2-sulfanylpentanal Traditional Name: 2-mercapto-5-phthalimido-valeraldehyde Formula: C13H13NO3S MolecularWeight: 263.31222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(C=O)S

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(C=O)S

InChI

InChI=1S/C13H13NO3S/c15-8-9(18)4-3-7-14-12(16)10-5-1-2-6-11(10)13(14)17/h1-2,5-6,8-9,18H,3-4,7H2