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

Systemtic Name: 5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-prop-2-enyl-indole-2,3-dione Openeye Name: 1-allyl-5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-indoline-2,3-dione CAS Name: 5-[[2-(phenoxymethyl)-1-pyrrolidinyl]sulfonyl]-1-prop-2-enylindole-2,3-dione IUPAC Name: 5-[2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-1-prop-2-enylindole-2,3-dione Traditional Name: 1-allyl-5-[2-(phenoxymethyl)pyrrolidino]sulfonyl-isatin Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3COC4=CC=CC=C4)C(=O)C1=O

Isomeric SMILES

C=CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3COC4=CC=CC=C4)C(=O)C1=O

InChI

InChI=1S/C22H22N2O5S/c1-2-12-23-20-11-10-18(14-19(20)21(25)22(23)26)30(27,28)24-13-6-7-16(24)15-29-17-8-4-3-5-9-17/h2-5,8-11,14,16H,1,6-7,12-13,15H2