methyl 2-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoyl]amino]-5-bromanyl-benzoate

Systemtic Name: methyl 2-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoyl]amino]-5-bromanyl-benzoate Openeye Name: methyl 5-bromo-2-[[2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanoyl]amino]benzoate CAS Name: 5-bromo-2-[[2-(1,3-dioxo-2-isoindolyl)-3-methyl-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[[2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoyl]amino]benzoate Traditional Name: 5-bromo-2-[(3-methyl-2-phthalimido-butanoyl)amino]benzoic acid methyl ester Formula: C21H19BrN2O5 MolecularWeight: 459.28996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=C(C=C1)Br)C(=O)OC)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)C(C(=O)NC1=C(C=C(C=C1)Br)C(=O)OC)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H19BrN2O5/c1-11(2)17(24-19(26)13-6-4-5-7-14(13)20(24)27)18(25)23-16-9-8-12(22)10-15(16)21(28)29-3/h4-11,17H,1-3H3,(H,23,25)