2-[3-[2-(4-bromophenyl)carbonylpyrazolidin-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[2-(4-bromophenyl)carbonylpyrazolidin-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[2-[(4-bromophenyl)-oxomethyl]-1-pyrazolidinyl]-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-[2-(4-bromobenzoyl)pyrazolidin-1-yl]-3-keto-propyl]isoindoline-1,3-quinone Formula: C21H18BrN3O4 MolecularWeight: 456.28932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)C2=CC=C(C=C2)Br)C(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(N(C1)C(=O)C2=CC=C(C=C2)Br)C(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H18BrN3O4/c22-15-8-6-14(7-9-15)19(27)25-12-3-11-24(25)18(26)10-13-23-20(28)16-4-1-2-5-17(16)21(23)29/h1-2,4-9H,3,10-13H2