1-[(4-methylphenyl)methyl]-5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-indole-2,3-dione

Systemtic Name: 1-[(4-methylphenyl)methyl]-5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-indole-2,3-dione Openeye Name: 5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-(p-tolylmethyl)indoline-2,3-dione CAS Name: 1-[(4-methylphenyl)methyl]-5-[[2-(phenoxymethyl)-1-pyrrolidinyl]sulfonyl]indole-2,3-dione IUPAC Name: 1-[(4-methylphenyl)methyl]-5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonylindole-2,3-dione Traditional Name: 1-(4-methylbenzyl)-5-[2-(phenoxymethyl)pyrrolidino]sulfonyl-isatin Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4COC5=CC=CC=C5)C(=O)C2=O

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4COC5=CC=CC=C5)C(=O)C2=O

InChI

InChI=1S/C27H26N2O5S/c1-19-9-11-20(12-10-19)17-28-25-14-13-23(16-24(25)26(30)27(28)31)35(32,33)29-15-5-6-21(29)18-34-22-7-3-2-4-8-22/h2-4,7-14,16,21H,5-6,15,17-18H2,1H3