4-[5-[2-(4-carboxyphenyl)-2-cyano-ethenyl]furan-2-yl]-3-methyl-benzoic acid

Systemtic Name: 4-[5-[2-(4-carboxyphenyl)-2-cyano-ethenyl]furan-2-yl]-3-methyl-benzoic acid Openeye Name: 4-[5-[2-(4-carboxyphenyl)-2-cyano-vinyl]-2-furyl]-3-methyl-benzoic acid CAS Name: 4-[5-[2-(4-carboxyphenyl)-2-cyanoethenyl]-2-furanyl]-3-methylbenzoic acid IUPAC Name: 4-[5-[2-(4-carboxyphenyl)-2-cyanoethenyl]furan-2-yl]-3-methylbenzoic acid Traditional Name: 4-[5-[2-(4-carboxyphenyl)-2-cyano-vinyl]-2-furyl]-3-methyl-benzoic acid Formula: C22H15NO5 MolecularWeight: 373.3582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)C2=CC=C(O2)C=C(C#N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)C2=CC=C(O2)C=C(C#N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H15NO5/c1-13-10-16(22(26)27)6-8-19(13)20-9-7-18(28-20)11-17(12-23)14-2-4-15(5-3-14)21(24)25/h2-11H,1H3,(H,24,25)(H,26,27)