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

Systemtic Name: methyl 4-[[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]methyl]benzoate CAS Name: 4-[[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(1,3-dioxoisoindol-2-yl)propanoylamino]methyl]benzoate Traditional Name: 4-[(3-phthalimidopropanoylamino)methyl]benzoic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H18N2O5/c1-27-20(26)14-8-6-13(7-9-14)12-21-17(23)10-11-22-18(24)15-4-2-3-5-16(15)19(22)25/h2-9H,10-12H2,1H3,(H,21,23)