2-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-(2-methanoylphenyl)ethanoic acid

Systemtic Name: 2-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-(2-methanoylphenyl)ethanoic acid Openeye Name: 2-[2-cyano-5-(3-thienylmethoxy)phenoxy]-2-(2-formylphenyl)acetic acid CAS Name: 2-[2-cyano-5-(3-thiophenylmethoxy)phenoxy]-2-(2-formylphenyl)acetic acid IUPAC Name: 2-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-(2-formylphenyl)acetic acid Traditional Name: 2-[2-cyano-5-(3-thenyloxy)phenoxy]-2-(2-formylphenyl)acetic acid Formula: C21H15NO5S MolecularWeight: 393.4125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=O)C(C(=O)O)OC2=C(C=CC(=C2)OCC3=CSC=C3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C=O)C(C(=O)O)OC2=C(C=CC(=C2)OCC3=CSC=C3)C#N

InChI

InChI=1S/C21H15NO5S/c22-10-15-5-6-17(26-12-14-7-8-28-13-14)9-19(15)27-20(21(24)25)18-4-2-1-3-16(18)11-23/h1-9,11,13,20H,12H2,(H,24,25)