2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-[(4-tert-butylphenyl)carbonylamino]propanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-[(4-tert-butylphenyl)carbonylamino]propanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 3-[(4-tert-butylbenzoyl)amino]propanoate CAS Name: 3-[[(4-tert-butylphenyl)-oxomethyl]amino]propanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 3-[(4-tert-butylbenzoyl)amino]propanoate Traditional Name: 3-[(4-tert-butylbenzoyl)amino]propionic acid 2-phthalimidoethyl ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O5/c1-24(2,3)17-10-8-16(9-11-17)21(28)25-13-12-20(27)31-15-14-26-22(29)18-6-4-5-7-19(18)23(26)30/h4-11H,12-15H2,1-3H3,(H,25,28)