4-[4-azanyl-1,3-bis(oxidanylidene)isoindol-2-yl]sulfonylbutanoic acid

Systemtic Name: 4-[4-azanyl-1,3-bis(oxidanylidene)isoindol-2-yl]sulfonylbutanoic acid Openeye Name: 4-(4-amino-1,3-dioxo-isoindolin-2-yl)sulfonylbutanoic acid CAS Name: 4-[(4-amino-1,3-dioxo-2-isoindolyl)sulfonyl]butanoic acid IUPAC Name: 4-(4-amino-1,3-dioxoisoindol-2-yl)sulfonylbutanoic acid Traditional Name: 4-(4-amino-1,3-diketo-isoindolin-2-yl)sulfonylbutyric acid Formula: C12H12N2O6S MolecularWeight: 312.29848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)N)C(=O)N(C2=O)S(=O)(=O)CCCC(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)N)C(=O)N(C2=O)S(=O)(=O)CCCC(=O)O

InChI

InChI=1S/C12H12N2O6S/c13-8-4-1-3-7-10(8)12(18)14(11(7)17)21(19,20)6-2-5-9(15)16/h1,3-4H,2,5-6,13H2,(H,15,16)