6-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-sulfanyl-hexanal

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-sulfanyl-hexanal Openeye Name: 6-(1,3-dioxoisoindolin-2-yl)-2-sulfanyl-hexanal CAS Name: 6-(1,3-dioxo-2-isoindolyl)-2-mercaptohexanal IUPAC Name: 6-(1,3-dioxoisoindol-2-yl)-2-sulfanylhexanal Traditional Name: 2-mercapto-6-phthalimido-hexanal Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO3S/c16-9-10(19)5-3-4-8-15-13(17)11-6-1-2-7-12(11)14(15)18/h1-2,6-7,9-10,19H,3-5,8H2