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

Systemtic Name: hexyl 4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoyl]amino]benzoate Openeye Name: hexyl 4-[[2-(1,3-dioxoisoindolin-2-yl)-4-methyl-pentanoyl]amino]benzoate CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)-4-methyl-1-oxopentyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoyl]amino]benzoate Traditional Name: 4-[(4-methyl-2-phthalimido-pentanoyl)amino]benzoic acid hexyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32N2O5/c1-4-5-6-9-16-34-27(33)19-12-14-20(15-13-19)28-24(30)23(17-18(2)3)29-25(31)21-10-7-8-11-22(21)26(29)32/h7-8,10-15,18,23H,4-6,9,16-17H2,1-3H3,(H,28,30)