hexyl (E)-1-(1,3-oxazol-4-ylmethoxy)-1,3-diphenyl-prop-2-ene-1-sulfonate

Systemtic Name: hexyl (E)-1-(1,3-oxazol-4-ylmethoxy)-1,3-diphenyl-prop-2-ene-1-sulfonate Openeye Name: hexyl (E)-1-(oxazol-4-ylmethoxy)-1,3-diphenyl-prop-2-ene-1-sulfonate CAS Name: (E)-1-(4-oxazolylmethoxy)-1,3-diphenyl-2-propene-1-sulfonic acid hexyl ester IUPAC Name: hexyl (E)-1-(1,3-oxazol-4-ylmethoxy)-1,3-diphenylprop-2-ene-1-sulfonate Traditional Name: (E)-1-(oxazol-4-ylmethoxy)-1,3-diphenyl-prop-2-ene-1-sulfonic acid hexyl ester Formula: C25H29NO5S MolecularWeight: 455.56646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOS(=O)(=O)C(C=CC1=CC=CC=C1)(C2=CC=CC=C2)OCC3=COC=N3

Isomeric SMILES

CCCCCCOS(=O)(=O)C(/C=C/C1=CC=CC=C1)(C2=CC=CC=C2)OCC3=COC=N3

InChI

InChI=1S/C25H29NO5S/c1-2-3-4-11-18-31-32(27,28)25(23-14-9-6-10-15-23,30-20-24-19-29-21-26-24)17-16-22-12-7-5-8-13-22/h5-10,12-17,19,21H,2-4,11,18,20H2,1H3/b17-16+