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

Systemtic Name: pentyl 4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]benzoate Openeye Name: pentyl 4-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]benzoate CAS Name: 4-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]benzoate Traditional Name: 4-(6-phthalimidohexanoylamino)benzoic acid amyl ester Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C26H30N2O5/c1-2-3-9-18-33-26(32)19-13-15-20(16-14-19)27-23(29)12-5-4-8-17-28-24(30)21-10-6-7-11-22(21)25(28)31/h6-7,10-11,13-16H,2-5,8-9,12,17-18H2,1H3,(H,27,29)