3-(4-bromophenyl)-3-oxidanyl-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]isoindol-1-one

Systemtic Name: 3-(4-bromophenyl)-3-oxidanyl-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]isoindol-1-one Openeye Name: 3-(4-bromophenyl)-3-hydroxy-2-[3-(2-oxopyrrolidin-1-yl)propyl]isoindolin-1-one CAS Name: 3-(4-bromophenyl)-3-hydroxy-2-[3-(2-oxo-1-pyrrolidinyl)propyl]-1-isoindolone IUPAC Name: 3-(4-bromophenyl)-3-hydroxy-2-[3-(2-oxopyrrolidin-1-yl)propyl]isoindol-1-one Traditional Name: 3-(4-bromophenyl)-3-hydroxy-2-[3-(2-ketopyrrolidino)propyl]isoindolin-1-one Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCN2C(=O)C3=CC=CC=C3C2(C4=CC=C(C=C4)Br)O

Isomeric SMILES

C1CC(=O)N(C1)CCCN2C(=O)C3=CC=CC=C3C2(C4=CC=C(C=C4)Br)O

InChI

InChI=1S/C21H21BrN2O3/c22-16-10-8-15(9-11-16)21(27)18-6-2-1-5-17(18)20(26)24(21)14-4-13-23-12-3-7-19(23)25/h1-2,5-6,8-11,27H,3-4,7,12-14H2