ethyl 4-[3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(5-bromo-1,3-dioxo-2-isoindolyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(5-bromo-1,3-dioxoisoindol-2-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(5-bromo-1,3-diketo-isoindolin-2-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H20BrN3O5 MolecularWeight: 438.2725

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C18H20BrN3O5/c1-2-27-18(26)21-9-7-20(8-10-21)15(23)5-6-22-16(24)13-4-3-12(19)11-14(13)17(22)25/h3-4,11H,2,5-10H2,1H3