2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-[(3-methylphenyl)carbonylamino]propanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-[(3-methylphenyl)carbonylamino]propanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 3-[(3-methylbenzoyl)amino]propanoate CAS Name: 3-[[(3-methylphenyl)-oxomethyl]amino]propanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 3-[(3-methylbenzoyl)amino]propanoate Traditional Name: 3-(m-toluoylamino)propionic acid 2-phthalimidoethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20N2O5/c1-14-5-4-6-15(13-14)19(25)22-10-9-18(24)28-12-11-23-20(26)16-7-2-3-8-17(16)21(23)27/h2-8,13H,9-12H2,1H3,(H,22,25)