2-[4-[(E)-3-(2-ethylphenyl)-3-phenyl-prop-2-enyl]sulfanylphenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-3-(2-ethylphenyl)-3-phenyl-prop-2-enyl]sulfanylphenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-3-(2-ethylphenyl)-3-phenyl-allyl]sulfanylphenoxy]acetic acid CAS Name: 2-[4-[[(E)-3-(2-ethylphenyl)-3-phenylprop-2-enyl]thio]phenoxy]acetic acid IUPAC Name: 2-[4-[(E)-3-(2-ethylphenyl)-3-phenylprop-2-enyl]sulfanylphenoxy]acetic acid Traditional Name: 2-[4-[[(E)-3-(2-ethylphenyl)-3-phenyl-allyl]thio]phenoxy]acetic acid Formula: C25H24O3S MolecularWeight: 404.52126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C(=CCSC2=CC=C(C=C2)OCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1/C(=C/CSC2=CC=C(C=C2)OCC(=O)O)/C3=CC=CC=C3

InChI

InChI=1S/C25H24O3S/c1-2-19-8-6-7-11-23(19)24(20-9-4-3-5-10-20)16-17-29-22-14-12-21(13-15-22)28-18-25(26)27/h3-16H,2,17-18H2,1H3,(H,26,27)/b24-16+