1-[(3R,4S)-7-methoxy-2,2-dimethyl-3-oxidanyl-6-(phenylsulfonyl)-3,4-dihydrochromen-4-yl]pyrrolidin-2-one

Systemtic Name: 1-[(3R,4S)-7-methoxy-2,2-dimethyl-3-oxidanyl-6-(phenylsulfonyl)-3,4-dihydrochromen-4-yl]pyrrolidin-2-one Openeye Name: 1-[(3R,4S)-6-(benzenesulfonyl)-3-hydroxy-7-methoxy-2,2-dimethyl-chroman-4-yl]pyrrolidin-2-one CAS Name: 1-[(3R,4S)-6-(benzenesulfonyl)-3-hydroxy-7-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-pyrrolidinone IUPAC Name: 1-[(3R,4S)-6-(benzenesulfonyl)-3-hydroxy-7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one Traditional Name: 1-[(3R,4S)-6-besyl-3-hydroxy-7-methoxy-2,2-dimethyl-chroman-4-yl]-2-pyrrolidone Formula: C22H25NO6S MolecularWeight: 431.502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=CC(=C(C=C2O1)OC)S(=O)(=O)C3=CC=CC=C3)N4CCCC4=O)O)C

Isomeric SMILES

CC1([C@@H]([C@H](C2=CC(=C(C=C2O1)OC)S(=O)(=O)C3=CC=CC=C3)N4CCCC4=O)O)C

InChI

InChI=1S/C22H25NO6S/c1-22(2)21(25)20(23-11-7-10-19(23)24)15-12-18(17(28-3)13-16(15)29-22)30(26,27)14-8-5-4-6-9-14/h4-6,8-9,12-13,20-21,25H,7,10-11H2,1-3H3/t20-,21+/m0/s1