2-[3-chloranyl-4-[(E)-3-(4-methylphenyl)-3-phenyl-prop-2-enyl]sulfanyl-phenoxy]ethanoic acid

Systemtic Name: 2-[3-chloranyl-4-[(E)-3-(4-methylphenyl)-3-phenyl-prop-2-enyl]sulfanyl-phenoxy]ethanoic acid Openeye Name: 2-[3-chloro-4-[(E)-3-phenyl-3-(p-tolyl)allyl]sulfanyl-phenoxy]acetic acid CAS Name: 2-[3-chloro-4-[[(E)-3-(4-methylphenyl)-3-phenylprop-2-enyl]thio]phenoxy]acetic acid IUPAC Name: 2-[3-chloro-4-[(E)-3-(4-methylphenyl)-3-phenylprop-2-enyl]sulfanylphenoxy]acetic acid Traditional Name: 2-[3-chloro-4-[[(E)-3-phenyl-3-(p-tolyl)allyl]thio]phenoxy]acetic acid Formula: C24H21ClO3S MolecularWeight: 424.93974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=CCSC2=C(C=C(C=C2)OCC(=O)O)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C/CSC2=C(C=C(C=C2)OCC(=O)O)Cl)/C3=CC=CC=C3

InChI

InChI=1S/C24H21ClO3S/c1-17-7-9-19(10-8-17)21(18-5-3-2-4-6-18)13-14-29-23-12-11-20(15-22(23)25)28-16-24(26)27/h2-13,15H,14,16H2,1H3,(H,26,27)/b21-13+