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4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]benzoate

4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]benzoate

Systemtic Name:4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]benzoate
Openeye Name:4-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]benzoate
CAS Name:4-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]benzoate
IUPAC Name:4-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]benzoate
Traditional Name:4-(6-phthalimidohexanoylamino)benzoate
Formula: C21H19N2O5-
MolecularWeight: 379.38596
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC(=O)NC3=CC=C(C=C3)C(=O)[O-]


Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC(=O)NC3=CC=C(C=C3)C(=O)[O-]


InChI

InChI=1S/C21H20N2O5/c24-18(22-15-11-9-14(10-12-15)21(27)28)8-2-1-5-13-23-19(25)16-6-3-4-7-17(16)20(23)26/h3-4,6-7,9-12H,1-2,5,8,13H2,(H,22,24)(H,27,28)/p-1


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