N-[(3R,4S)-2,2-dimethyl-3-oxidanyl-6-phenylmethoxy-3,4-dihydrochromen-4-yl]-N-methyl-ethanesulfonamide

Systemtic Name: N-[(3R,4S)-2,2-dimethyl-3-oxidanyl-6-phenylmethoxy-3,4-dihydrochromen-4-yl]-N-methyl-ethanesulfonamide Openeye Name: N-[(3R,4S)-6-benzyloxy-3-hydroxy-2,2-dimethyl-chroman-4-yl]-N-methyl-ethanesulfonamide CAS Name: N-[(3R,4S)-3-hydroxy-2,2-dimethyl-6-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-4-yl]-N-methylethanesulfonamide IUPAC Name: N-[(3R,4S)-3-hydroxy-2,2-dimethyl-6-phenylmethoxy-3,4-dihydrochromen-4-yl]-N-methylethanesulfonamide Traditional Name: N-[(3R,4S)-6-benzoxy-3-hydroxy-2,2-dimethyl-chroman-4-yl]-N-methyl-ethanesulfonamide Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(C)C1C(C(OC2=C1C=C(C=C2)OCC3=CC=CC=C3)(C)C)O

Isomeric SMILES

CCS(=O)(=O)N(C)[C@@H]1[C@H](C(OC2=C1C=C(C=C2)OCC3=CC=CC=C3)(C)C)O

InChI

InChI=1S/C21H27NO5S/c1-5-28(24,25)22(4)19-17-13-16(26-14-15-9-7-6-8-10-15)11-12-18(17)27-21(2,3)20(19)23/h6-13,19-20,23H,5,14H2,1-4H3/t19-,20+/m0/s1