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

Systemtic Name: methyl 4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]benzoate Openeye Name: methyl 4-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]benzoate CAS Name: 4-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]benzoate Traditional Name: 4-(6-phthalimidohexanoylamino)benzoic acid methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O5/c1-29-22(28)15-10-12-16(13-11-15)23-19(25)9-3-2-6-14-24-20(26)17-7-4-5-8-18(17)21(24)27/h4-5,7-8,10-13H,2-3,6,9,14H2,1H3,(H,23,25)