1-phenylpentyl (E)-1-(1,3-oxazol-4-ylmethoxy)-3-phenyl-prop-2-ene-1-sulfonate

Systemtic Name: 1-phenylpentyl (E)-1-(1,3-oxazol-4-ylmethoxy)-3-phenyl-prop-2-ene-1-sulfonate Openeye Name: 1-phenylpentyl (E)-1-(oxazol-4-ylmethoxy)-3-phenyl-prop-2-ene-1-sulfonate CAS Name: (E)-1-(4-oxazolylmethoxy)-3-phenyl-2-propene-1-sulfonic acid 1-phenylpentyl ester IUPAC Name: 1-phenylpentyl (E)-1-(1,3-oxazol-4-ylmethoxy)-3-phenylprop-2-ene-1-sulfonate Traditional Name: (E)-1-(oxazol-4-ylmethoxy)-3-phenyl-prop-2-ene-1-sulfonic acid 1-phenylpentyl ester Formula: C24H27NO5S MolecularWeight: 441.53988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1)OS(=O)(=O)C(C=CC2=CC=CC=C2)OCC3=COC=N3

Isomeric SMILES

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

InChI

InChI=1S/C24H27NO5S/c1-2-3-14-23(21-12-8-5-9-13-21)30-31(26,27)24(29-18-22-17-28-19-25-22)16-15-20-10-6-4-7-11-20/h4-13,15-17,19,23-24H,2-3,14,18H2,1H3/b16-15+