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

Systemtic Name: (4-tert-butylphenyl)methyl 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate Openeye Name: (4-tert-butylphenyl)methyl 3-[(1,3-dioxoisoindolin-2-yl)methyl]benzoate CAS Name: 3-[(1,3-dioxo-2-isoindolyl)methyl]benzoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 3-[(1,3-dioxoisoindol-2-yl)methyl]benzoate Traditional Name: 3-(phthalimidomethyl)benzoic acid (4-tert-butylbenzyl) ester Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H25NO4/c1-27(2,3)21-13-11-18(12-14-21)17-32-26(31)20-8-6-7-19(15-20)16-28-24(29)22-9-4-5-10-23(22)25(28)30/h4-15H,16-17H2,1-3H3