3-[5-(2,2-dicyanoethenyl)furan-2-yl]-2-methyl-benzoic acid

Systemtic Name: 3-[5-(2,2-dicyanoethenyl)furan-2-yl]-2-methyl-benzoic acid Openeye Name: 3-[5-(2,2-dicyanovinyl)-2-furyl]-2-methyl-benzoic acid CAS Name: 3-[5-(2,2-dicyanoethenyl)-2-furanyl]-2-methylbenzoic acid IUPAC Name: 3-[5-(2,2-dicyanoethenyl)furan-2-yl]-2-methylbenzoic acid Traditional Name: 3-[5-(2,2-dicyanovinyl)-2-furyl]-2-methyl-benzoic acid Formula: C16H10N2O3 MolecularWeight: 278.2622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1C(=O)O)C2=CC=C(O2)C=C(C#N)C#N

Isomeric SMILES

CC1=C(C=CC=C1C(=O)O)C2=CC=C(O2)C=C(C#N)C#N

InChI

InChI=1S/C16H10N2O3/c1-10-13(3-2-4-14(10)16(19)20)15-6-5-12(21-15)7-11(8-17)9-18/h2-7H,1H3,(H,19,20)