(4-propoxyphenyl) 3-(4-propoxyphenyl)sulfonylprop-2-ynoate

Systemtic Name: (4-propoxyphenyl) 3-(4-propoxyphenyl)sulfonylprop-2-ynoate Openeye Name: (4-propoxyphenyl) 3-(4-propoxyphenyl)sulfonylprop-2-ynoate CAS Name: 3-(4-propoxyphenyl)sulfonyl-2-propynoic acid (4-propoxyphenyl) ester IUPAC Name: (4-propoxyphenyl) 3-(4-propoxyphenyl)sulfonylprop-2-ynoate Traditional Name: 3-(4-propoxyphenyl)sulfonylpropiolic acid (4-propoxyphenyl) ester Formula: C21H22O6S MolecularWeight: 402.46078

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OC(=O)C#CS(=O)(=O)C2=CC=C(C=C2)OCCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)OC(=O)C#CS(=O)(=O)C2=CC=C(C=C2)OCCC

InChI

InChI=1S/C21H22O6S/c1-3-14-25-17-5-7-19(8-6-17)27-21(22)13-16-28(23,24)20-11-9-18(10-12-20)26-15-4-2/h5-12H,3-4,14-15H2,1-2H3