5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-(phenylmethyl)indole-2,3-dione

Systemtic Name: 5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-(phenylmethyl)indole-2,3-dione Openeye Name: 1-benzyl-5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-indoline-2,3-dione CAS Name: 5-[[2-(phenoxymethyl)-1-pyrrolidinyl]sulfonyl]-1-(phenylmethyl)indole-2,3-dione IUPAC Name: 1-benzyl-5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonylindole-2,3-dione Traditional Name: 1-benzyl-5-[2-(phenoxymethyl)pyrrolidino]sulfonyl-isatin Formula: C26H24N2O5S MolecularWeight: 476.54416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=CC=C4)COC5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=CC=C4)COC5=CC=CC=C5

InChI

InChI=1S/C26H24N2O5S/c29-25-23-16-22(13-14-24(23)27(26(25)30)17-19-8-3-1-4-9-19)34(31,32)28-15-7-10-20(28)18-33-21-11-5-2-6-12-21/h1-6,8-9,11-14,16,20H,7,10,15,17-18H2