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

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-[(4-tert-butylphenyl)carbonylamino]ethanoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 2-[(4-tert-butylbenzoyl)amino]acetate CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]acetic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 2-[(4-tert-butylbenzoyl)amino]acetate Traditional Name: 2-[(4-tert-butylbenzoyl)amino]acetic acid 4-phthalimidobutyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)OCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)OCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C25H28N2O5/c1-25(2,3)18-12-10-17(11-13-18)22(29)26-16-21(28)32-15-7-6-14-27-23(30)19-8-4-5-9-20(19)24(27)31/h4-5,8-13H,6-7,14-16H2,1-3H3,(H,26,29)