ethyl 4-[[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]methyl-ethanoyl-amino]benzoate

Systemtic Name: ethyl 4-[[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]methyl-ethanoyl-amino]benzoate Openeye Name: ethyl 4-[acetyl-[(5-bromo-1,3-dioxo-isoindolin-2-yl)methyl]amino]benzoate CAS Name: 4-[acetyl-[(5-bromo-1,3-dioxo-2-isoindolyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[acetyl-[(5-bromo-1,3-dioxoisoindol-2-yl)methyl]amino]benzoate Traditional Name: 4-[acetyl-[(5-bromo-1,3-diketo-isoindolin-2-yl)methyl]amino]benzoic acid ethyl ester Formula: C20H17BrN2O5 MolecularWeight: 445.26338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C(=O)C

InChI

InChI=1S/C20H17BrN2O5/c1-3-28-20(27)13-4-7-15(8-5-13)22(12(2)24)11-23-18(25)16-9-6-14(21)10-17(16)19(23)26/h4-10H,3,11H2,1-2H3