4-ethyl-3-methyl-3-oxidanyl-5-(phenylsulfonyl)-4-pyrrolidin-1-yl-chromen-2-one

Systemtic Name: 4-ethyl-3-methyl-3-oxidanyl-5-(phenylsulfonyl)-4-pyrrolidin-1-yl-chromen-2-one Openeye Name: 5-(benzenesulfonyl)-4-ethyl-3-hydroxy-3-methyl-4-pyrrolidin-1-yl-chroman-2-one CAS Name: 5-(benzenesulfonyl)-4-ethyl-3-hydroxy-3-methyl-4-(1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: 5-(benzenesulfonyl)-4-ethyl-3-hydroxy-3-methyl-4-pyrrolidin-1-ylchromen-2-one Traditional Name: 5-besyl-4-ethyl-3-hydroxy-3-methyl-4-pyrrolidino-chroman-2-one Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(C=CC=C2S(=O)(=O)C3=CC=CC=C3)OC(=O)C1(C)O)N4CCCC4

Isomeric SMILES

CCC1(C2=C(C=CC=C2S(=O)(=O)C3=CC=CC=C3)OC(=O)C1(C)O)N4CCCC4

InChI

InChI=1S/C22H25NO5S/c1-3-22(23-14-7-8-15-23)19-17(28-20(24)21(22,2)25)12-9-13-18(19)29(26,27)16-10-5-4-6-11-16/h4-6,9-13,25H,3,7-8,14-15H2,1-2H3