4-[2-(4-butan-2-yloxyphenyl)-1-cyano-ethenyl]benzoic acid

Systemtic Name: 4-[2-(4-butan-2-yloxyphenyl)-1-cyano-ethenyl]benzoic acid Openeye Name: 4-[1-cyano-2-(4-sec-butoxyphenyl)vinyl]benzoic acid CAS Name: 4-[2-(4-butan-2-yloxyphenyl)-1-cyanoethenyl]benzoic acid IUPAC Name: 4-[2-(4-butan-2-yloxyphenyl)-1-cyanoethenyl]benzoic acid Traditional Name: 4-[1-cyano-2-(4-sec-butoxyphenyl)vinyl]benzoic acid Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C20H19NO3/c1-3-14(2)24-19-10-4-15(5-11-19)12-18(13-21)16-6-8-17(9-7-16)20(22)23/h4-12,14H,3H2,1-2H3,(H,22,23)