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

Systemtic Name: 1-[(3R,4S)-7-ethoxy-2,2-dimethyl-3-oxidanyl-6-(phenylsulfonyl)-3,4-dihydrochromen-4-yl]pyrrolidin-2-one Openeye Name: 1-[(3R,4S)-6-(benzenesulfonyl)-7-ethoxy-3-hydroxy-2,2-dimethyl-chroman-4-yl]pyrrolidin-2-one CAS Name: 1-[(3R,4S)-6-(benzenesulfonyl)-7-ethoxy-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-pyrrolidinone IUPAC Name: 1-[(3R,4S)-6-(benzenesulfonyl)-7-ethoxy-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-one Traditional Name: 1-[(3R,4S)-6-besyl-7-ethoxy-3-hydroxy-2,2-dimethyl-chroman-4-yl]-2-pyrrolidone Formula: C23H27NO6S MolecularWeight: 445.52858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(C(C(OC2=C1)(C)C)O)N3CCCC3=O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=C2[C@@H]([C@H](C(OC2=C1)(C)C)O)N3CCCC3=O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H27NO6S/c1-4-29-18-14-17-16(13-19(18)31(27,28)15-9-6-5-7-10-15)21(22(26)23(2,3)30-17)24-12-8-11-20(24)25/h5-7,9-10,13-14,21-22,26H,4,8,11-12H2,1-3H3/t21-,22+/m0/s1