(E)-3-[3-chloranyl-4-[2-(hydroxymethyl)phenyl]sulfanyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-chloranyl-4-[2-(hydroxymethyl)phenyl]sulfanyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-chloro-4-[2-(hydroxymethyl)phenyl]sulfanyl-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-chloro-4-[[2-(hydroxymethyl)phenyl]thio]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-chloro-4-[2-(hydroxymethyl)phenyl]sulfanylphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-chloro-4-[(2-methylolphenyl)thio]phenyl]acrylic acid Formula: C16H13ClO3S MolecularWeight: 320.79062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CO)SC2=C(C=C(C=C2)C=CC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CO)SC2=C(C=C(C=C2)/C=C/C(=O)O)Cl

InChI

InChI=1S/C16H13ClO3S/c17-13-9-11(6-8-16(19)20)5-7-15(13)21-14-4-2-1-3-12(14)10-18/h1-9,18H,10H2,(H,19,20)/b8-6+