4-[[(E)-3-(4-ethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enyl]sulfamoyl]benzoic acid

Systemtic Name: 4-[[(E)-3-(4-ethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enyl]sulfamoyl]benzoic acid Openeye Name: 4-[[(E)-3-(4-ethoxyphenyl)-3-(4-methoxyphenyl)allyl]sulfamoyl]benzoic acid CAS Name: 4-[[(E)-3-(4-ethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enyl]sulfamoyl]benzoic acid IUPAC Name: 4-[[(E)-3-(4-ethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enyl]sulfamoyl]benzoic acid Traditional Name: 4-[[(E)-3-(4-methoxyphenyl)-3-p-phenetyl-allyl]sulfamoyl]benzoic acid Formula: C25H25NO6S MolecularWeight: 467.5341

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=CCNS(=O)(=O)C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)/C(=C/CNS(=O)(=O)C2=CC=C(C=C2)C(=O)O)/C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H25NO6S/c1-3-32-22-12-6-19(7-13-22)24(18-4-10-21(31-2)11-5-18)16-17-26-33(29,30)23-14-8-20(9-15-23)25(27)28/h4-16,26H,3,17H2,1-2H3,(H,27,28)/b24-16+