(E)-3-[3-methoxy-4-(3-phenylsulfanylpropoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-methoxy-4-(3-phenylsulfanylpropoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-methoxy-4-(3-phenylsulfanylpropoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-methoxy-4-[3-(phenylthio)propoxy]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-methoxy-4-(3-phenylsulfanylpropoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-methoxy-4-[3-(phenylthio)propoxy]phenyl]acrylic acid Formula: C19H20O4S MolecularWeight: 344.4247

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)O)OCCCSC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)O)OCCCSC2=CC=CC=C2

InChI

InChI=1S/C19H20O4S/c1-22-18-14-15(9-11-19(20)21)8-10-17(18)23-12-5-13-24-16-6-3-2-4-7-16/h2-4,6-11,14H,5,12-13H2,1H3,(H,20,21)/b11-9+