2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid 2-phthalimidoethyl ester Formula: C15H11BrN2O4 MolecularWeight: 363.16284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C3=CC(=CN3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C3=CC(=CN3)Br

InChI

InChI=1S/C15H11BrN2O4/c16-9-7-12(17-8-9)15(21)22-6-5-18-13(19)10-3-1-2-4-11(10)14(18)20/h1-4,7-8,17H,5-6H2