3-[3-[3-(5-chloranyl-2-phenylmethoxy-phenyl)thiophen-2-yl]phenyl]propanoic acid

Systemtic Name: 3-[3-[3-(5-chloranyl-2-phenylmethoxy-phenyl)thiophen-2-yl]phenyl]propanoic acid Openeye Name: 3-[3-[3-(2-benzyloxy-5-chloro-phenyl)-2-thienyl]phenyl]propanoic acid CAS Name: 3-[3-[3-(5-chloro-2-phenylmethoxyphenyl)-2-thiophenyl]phenyl]propanoic acid IUPAC Name: 3-[3-[3-(5-chloro-2-phenylmethoxyphenyl)thiophen-2-yl]phenyl]propanoic acid Traditional Name: 3-[3-[3-(2-benzoxy-5-chloro-phenyl)-2-thienyl]phenyl]propionic acid Formula: C26H21ClO3S MolecularWeight: 448.96114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=C(SC=C3)C4=CC(=CC=C4)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=C(SC=C3)C4=CC(=CC=C4)CCC(=O)O

InChI

InChI=1S/C26H21ClO3S/c27-21-10-11-24(30-17-19-5-2-1-3-6-19)23(16-21)22-13-14-31-26(22)20-8-4-7-18(15-20)9-12-25(28)29/h1-8,10-11,13-16H,9,12,17H2,(H,28,29)