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

Systemtic Name: 5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-(3-phenylpropyl)indole-2,3-dione Openeye Name: 5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-(3-phenylpropyl)indoline-2,3-dione CAS Name: 5-[[2-(phenoxymethyl)-1-pyrrolidinyl]sulfonyl]-1-(3-phenylpropyl)indole-2,3-dione IUPAC Name: 5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-(3-phenylpropyl)indole-2,3-dione Traditional Name: 5-[2-(phenoxymethyl)pyrrolidino]sulfonyl-1-(3-phenylpropyl)isatin Formula: C28H28N2O5S MolecularWeight: 504.59732

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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)CCCC4=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)CCCC4=CC=CC=C4)COC5=CC=CC=C5

InChI

InChI=1S/C28H28N2O5S/c31-27-25-19-24(15-16-26(25)29(28(27)32)17-7-11-21-9-3-1-4-10-21)36(33,34)30-18-8-12-22(30)20-35-23-13-5-2-6-14-23/h1-6,9-10,13-16,19,22H,7-8,11-12,17-18,20H2