2-[(E)-2-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]ethenyl]-5-ethylsulfonyl-1,3-benzoxazole

Systemtic Name: 2-[(E)-2-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]ethenyl]-5-ethylsulfonyl-1,3-benzoxazole Openeye Name: 2-[(E)-2-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]vinyl]-5-ethylsulfonyl-1,3-benzoxazole CAS Name: 2-[(E)-2-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]ethenyl]-5-ethylsulfonyl-1,3-benzoxazole IUPAC Name: 2-[(E)-2-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]ethenyl]-5-ethylsulfonyl-1,3-benzoxazole Traditional Name: 5-esyl-2-[(E)-2-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]vinyl]-1,3-benzoxazole Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=CC3=NC4=C(O3)C=CC(=C4)S(=O)(=O)CC)OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=C/C3=NC4=C(O3)C=CC(=C4)S(=O)(=O)CC)O[C@H](C2)C

InChI

InChI=1S/C22H23NO5S/c1-4-26-20-12-16-10-14(3)27-21(16)11-15(20)6-9-22-23-18-13-17(29(24,25)5-2)7-8-19(18)28-22/h6-9,11-14H,4-5,10H2,1-3H3/b9-6+/t14-/m0/s1