(E)-3-[5-chloranyl-2-(3-phenylpropoxy)phenyl]-2-thiophen-2-yl-prop-2-enoic acid

Systemtic Name: (E)-3-[5-chloranyl-2-(3-phenylpropoxy)phenyl]-2-thiophen-2-yl-prop-2-enoic acid Openeye Name: (E)-3-[5-chloro-2-(3-phenylpropoxy)phenyl]-2-(2-thienyl)prop-2-enoic acid CAS Name: (E)-3-[5-chloro-2-(3-phenylpropoxy)phenyl]-2-thiophen-2-yl-2-propenoic acid IUPAC Name: (E)-3-[5-chloro-2-(3-phenylpropoxy)phenyl]-2-thiophen-2-ylprop-2-enoic acid Traditional Name: (E)-3-[5-chloro-2-(3-phenylpropoxy)phenyl]-2-(2-thienyl)acrylic acid Formula: C22H19ClO3S MolecularWeight: 398.90246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Cl)C=C(C3=CC=CS3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)Cl)/C=C(/C3=CC=CS3)\C(=O)O

InChI

InChI=1S/C22H19ClO3S/c23-18-10-11-20(26-12-4-8-16-6-2-1-3-7-16)17(14-18)15-19(22(24)25)21-9-5-13-27-21/h1-3,5-7,9-11,13-15H,4,8,12H2,(H,24,25)/b19-15-