1-[(4-iodanylphenyl)methyl]-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonyl-indole-2,3-dione

Systemtic Name: 1-[(4-iodanylphenyl)methyl]-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonyl-indole-2,3-dione Openeye Name: 1-[(4-iodanylphenyl)methyl]-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonyl-indoline-2,3-dione CAS Name: 1-[(4-iodanylphenyl)methyl]-5-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]sulfonyl]indole-2,3-dione IUPAC Name: 1-[(4-iodanylphenyl)methyl]-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonylindole-2,3-dione Traditional Name: 1-(4-iodanylbenzyl)-5-[(2S)-2-(methoxymethyl)pyrrolidino]sulfonyl-isatin Formula: C21H21IN2O5S MolecularWeight: 536.372438

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=C(C=C4)I

Isomeric SMILES

COC[C@@H]1CCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=C(C=C4)[123I]

InChI

InChI=1S/C21H21IN2O5S/c1-29-13-16-3-2-10-24(16)30(27,28)17-8-9-19-18(11-17)20(25)21(26)23(19)12-14-4-6-15(22)7-5-14/h4-9,11,16H,2-3,10,12-13H2,1H3/t16-/m0/s1/i22-4