1-(4-iodophenyl)-3-[4-(phenylmethyl)piperazin-1-yl]pyrrolidine-2,5-dione

Systemtic Name: 1-(4-iodophenyl)-3-[4-(phenylmethyl)piperazin-1-yl]pyrrolidine-2,5-dione Openeye Name: 3-(4-benzylpiperazin-1-yl)-1-(4-iodophenyl)pyrrolidine-2,5-dione CAS Name: 1-(4-iodophenyl)-3-[4-(phenylmethyl)-1-piperazinyl]pyrrolidine-2,5-dione IUPAC Name: 3-(4-benzylpiperazin-1-yl)-1-(4-iodophenyl)pyrrolidine-2,5-dione Traditional Name: 3-(4-benzylpiperazino)-1-(4-iodophenyl)pyrrolidine-2,5-quinone Formula: C21H22IN3O2 MolecularWeight: 475.32275

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3CC(=O)N(C3=O)C4=CC=C(C=C4)I

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3CC(=O)N(C3=O)C4=CC=C(C=C4)I

InChI

InChI=1S/C21H22IN3O2/c22-17-6-8-18(9-7-17)25-20(26)14-19(21(25)27)24-12-10-23(11-13-24)15-16-4-2-1-3-5-16/h1-9,19H,10-15H2