tert-butyl 2-[4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]phenyl]cyclohexane-1-carboxylate

Systemtic Name: tert-butyl 2-[4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]phenyl]cyclohexane-1-carboxylate Openeye Name: tert-butyl 2-[4-[(1,3-dioxoisoindolin-2-yl)methyl]phenyl]cyclohexanecarboxylate CAS Name: 2-[4-[(1,3-dioxo-2-isoindolyl)methyl]phenyl]-1-cyclohexanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(1,3-dioxoisoindol-2-yl)methyl]phenyl]cyclohexane-1-carboxylate Traditional Name: 2-[4-(phthalimidomethyl)phenyl]cyclohexanecarboxylic acid tert-butyl ester Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCCC1C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)(C)OC(=O)C1CCCCC1C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H29NO4/c1-26(2,3)31-25(30)22-11-7-4-8-19(22)18-14-12-17(13-15-18)16-27-23(28)20-9-5-6-10-21(20)24(27)29/h5-6,9-10,12-15,19,22H,4,7-8,11,16H2,1-3H3