[2,2-dimethyl-4-[7-(3-phenylpropanoylamino)dibenzofuran-2-yl]sulfonyl-thiomorpholin-3-yl] hydrogen carbonate

Systemtic Name: [2,2-dimethyl-4-[7-(3-phenylpropanoylamino)dibenzofuran-2-yl]sulfonyl-thiomorpholin-3-yl] hydrogen carbonate Openeye Name: [2,2-dimethyl-4-[7-(3-phenylpropanoylamino)dibenzofuran-2-yl]sulfonyl-thiomorpholin-3-yl] hydrogen carbonate CAS Name: carbonic acid [2,2-dimethyl-4-[[7-[(1-oxo-3-phenylpropyl)amino]-2-dibenzofuranyl]sulfonyl]-3-thiomorpholinyl] ester IUPAC Name: [2,2-dimethyl-4-[7-(3-phenylpropanoylamino)dibenzofuran-2-yl]sulfonylthiomorpholin-3-yl] hydrogen carbonate Traditional Name: carbonic acid [4-[7-(hydrocinnamoylamino)dibenzofuran-2-yl]sulfonyl-2,2-dimethyl-thiomorpholin-3-yl] ester Formula: C28H28N2O7S2 MolecularWeight: 568.66112

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)S(=O)(=O)C2=CC3=C(C=C2)OC4=C3C=CC(=C4)NC(=O)CCC5=CC=CC=C5)OC(=O)O)C

Isomeric SMILES

CC1(C(N(CCS1)S(=O)(=O)C2=CC3=C(C=C2)OC4=C3C=CC(=C4)NC(=O)CCC5=CC=CC=C5)OC(=O)O)C

InChI

InChI=1S/C28H28N2O7S2/c1-28(2)26(37-27(32)33)30(14-15-38-28)39(34,35)20-10-12-23-22(17-20)21-11-9-19(16-24(21)36-23)29-25(31)13-8-18-6-4-3-5-7-18/h3-7,9-12,16-17,26H,8,13-15H2,1-2H3,(H,29,31)(H,32,33)