(6S,7R,7aS)-7-(4-methoxyphenyl)-3,3-dimethyl-6-(phenylsulfonyl)-1,6,7,7a-tetrahydropyrrolo[1,2-c][1,3]oxazol-5-one

Systemtic Name: (6S,7R,7aS)-7-(4-methoxyphenyl)-3,3-dimethyl-6-(phenylsulfonyl)-1,6,7,7a-tetrahydropyrrolo[1,2-c][1,3]oxazol-5-one Openeye Name: (6S,7R,7aS)-6-(benzenesulfonyl)-7-(4-methoxyphenyl)-3,3-dimethyl-1,6,7,7a-tetrahydropyrrolo[1,2-c]oxazol-5-one CAS Name: (6S,7R,7aS)-6-(benzenesulfonyl)-7-(4-methoxyphenyl)-3,3-dimethyl-1,6,7,7a-tetrahydropyrrolo[1,2-c]oxazol-5-one IUPAC Name: (6S,7R,7aS)-6-(benzenesulfonyl)-7-(4-methoxyphenyl)-3,3-dimethyl-1,6,7,7a-tetrahydropyrrolo[1,2-c][1,3]oxazol-5-one Traditional Name: (6S,7R,7aS)-6-besyl-7-(4-methoxyphenyl)-3,3-dimethyl-1,6,7,7a-tetrahydropyrrolo[1,2-c]oxazol-5-one Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N2C(CO1)C(C(C2=O)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1(N2[C@H](CO1)[C@H]([C@@H](C2=O)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C21H23NO5S/c1-21(2)22-17(13-27-21)18(14-9-11-15(26-3)12-10-14)19(20(22)23)28(24,25)16-7-5-4-6-8-16/h4-12,17-19H,13H2,1-3H3/t17-,18-,19+/m1/s1