ethyl 4-[2-(3-oxidanylidene-1H-isoindol-2-yl)pentanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(3-oxidanylidene-1H-isoindol-2-yl)pentanoylamino]benzoate Openeye Name: ethyl 4-[2-(1-oxoisoindolin-2-yl)pentanoylamino]benzoate CAS Name: 4-[[1-oxo-2-(3-oxo-1H-isoindol-2-yl)pentyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-oxo-1H-isoindol-2-yl)pentanoylamino]benzoate Traditional Name: 4-[2-(1-ketoisoindolin-2-yl)pentanoylamino]benzoic acid ethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CCCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H24N2O4/c1-3-7-19(24-14-16-8-5-6-9-18(16)21(24)26)20(25)23-17-12-10-15(11-13-17)22(27)28-4-2/h5-6,8-13,19H,3-4,7,14H2,1-2H3,(H,23,25)