3-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]pentylamino]propylsulfanylphosphonic acid

Systemtic Name: 3-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]pentylamino]propylsulfanylphosphonic acid Openeye Name: 3-[5-(1,3-dioxoisoindolin-2-yl)pentylamino]propylsulfanylphosphonic acid CAS Name: [3-[5-(1,3-dioxo-2-isoindolyl)pentylamino]propylthio]phosphonic acid IUPAC Name: 3-[5-(1,3-dioxoisoindol-2-yl)pentylamino]propylsulfanylphosphonic acid Traditional Name: [3-(5-phthalimidopentylamino)propylthio]phosphonic acid Formula: C16H23N2O5PS MolecularWeight: 386.402981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCNCCCSP(=O)(O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCNCCCSP(=O)(O)O

InChI

InChI=1S/C16H23N2O5PS/c19-15-13-7-2-3-8-14(13)16(20)18(15)11-5-1-4-9-17-10-6-12-25-24(21,22)23/h2-3,7-8,17H,1,4-6,9-12H2,(H2,21,22,23)