hexyl 4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoyl]amino]benzoate

Systemtic Name: hexyl 4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoyl]amino]benzoate Openeye Name: hexyl 4-[[2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanoyl]amino]benzoate CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)-3-methyl-1-oxobutyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoyl]amino]benzoate Traditional Name: 4-[(3-methyl-2-phthalimido-butanoyl)amino]benzoic acid hexyl ester Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C(C)C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C(C)C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C26H30N2O5/c1-4-5-6-9-16-33-26(32)18-12-14-19(15-13-18)27-23(29)22(17(2)3)28-24(30)20-10-7-8-11-21(20)25(28)31/h7-8,10-15,17,22H,4-6,9,16H2,1-3H3,(H,27,29)