1-[(3R,4S)-2,2-dimethyl-6-(2-methylphenyl)sulfonyl-3-oxidanyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one

Systemtic Name: 1-[(3R,4S)-2,2-dimethyl-6-(2-methylphenyl)sulfonyl-3-oxidanyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one Openeye Name: 1-[(3R,4S)-3-hydroxy-2,2-dimethyl-6-(o-tolylsulfonyl)chroman-4-yl]pyrrolidin-2-one CAS Name: 1-[(3R,4S)-3-hydroxy-2,2-dimethyl-6-(2-methylphenyl)sulfonyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-pyrrolidinone IUPAC Name: 1-[(3R,4S)-3-hydroxy-2,2-dimethyl-6-(2-methylphenyl)sulfonyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one Traditional Name: 1-[(3R,4S)-3-hydroxy-2,2-dimethyl-6-(o-tolylsulfonyl)chroman-4-yl]-2-pyrrolidone Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)C2=CC3=C(C=C2)OC(C(C3N4CCCC4=O)O)(C)C

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)C2=CC3=C(C=C2)OC([C@@H]([C@H]3N4CCCC4=O)O)(C)C

InChI

InChI=1S/C22H25NO5S/c1-14-7-4-5-8-18(14)29(26,27)15-10-11-17-16(13-15)20(21(25)22(2,3)28-17)23-12-6-9-19(23)24/h4-5,7-8,10-11,13,20-21,25H,6,9,12H2,1-3H3/t20-,21+/m0/s1