(E)-3-[2-(2-naphthalen-2-ylethoxy)-4-(phenylsulfanylmethyl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(2-naphthalen-2-ylethoxy)-4-(phenylsulfanylmethyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-[2-(2-naphthyl)ethoxy]-4-(phenylsulfanylmethyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-[2-(2-naphthalenyl)ethoxy]-4-[(phenylthio)methyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(2-naphthalen-2-ylethoxy)-4-(phenylsulfanylmethyl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-[2-(2-naphthyl)ethoxy]-4-[(phenylthio)methyl]phenyl]acrylic acid Formula: C28H24O3S MolecularWeight: 440.55336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC2=CC(=C(C=C2)C=CC(=O)O)OCCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)SCC2=CC(=C(C=C2)/C=C/C(=O)O)OCCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H24O3S/c29-28(30)15-14-24-13-11-22(20-32-26-8-2-1-3-9-26)19-27(24)31-17-16-21-10-12-23-6-4-5-7-25(23)18-21/h1-15,18-19H,16-17,20H2,(H,29,30)/b15-14+