2-[2-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-[2-(4-methylsulfonylphenyl)-1-oxoethyl]-1-pyrazolidinyl]-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-[2-[2-(4-mesylphenyl)acetyl]pyrazolidin-1-yl]ethyl]isoindoline-1,3-quinone Formula: C22H21N3O6S MolecularWeight: 455.48364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC(=O)N2CCCN2C(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC(=O)N2CCCN2C(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21N3O6S/c1-32(30,31)16-9-7-15(8-10-16)13-19(26)24-11-4-12-25(24)20(27)14-23-21(28)17-5-2-3-6-18(17)22(23)29/h2-3,5-10H,4,11-14H2,1H3