5-cyano-6,6-bis(4-methoxyphenyl)hex-5-enoic acid

Systemtic Name: 5-cyano-6,6-bis(4-methoxyphenyl)hex-5-enoic acid Openeye Name: 5-cyano-6,6-bis(4-methoxyphenyl)hex-5-enoic acid CAS Name: 5-cyano-6,6-bis(4-methoxyphenyl)-5-hexenoic acid IUPAC Name: 5-cyano-6,6-bis(4-methoxyphenyl)hex-5-enoic acid Traditional Name: 5-cyano-6,6-bis(4-methoxyphenyl)hex-5-enoic acid Formula: C21H21NO4 MolecularWeight: 351.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C(CCCC(=O)O)C#N)C2=CC=C(C=C2)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=C(CCCC(=O)O)C#N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H21NO4/c1-25-18-10-6-15(7-11-18)21(16-8-12-19(26-2)13-9-16)17(14-22)4-3-5-20(23)24/h6-13H,3-5H2,1-2H3,(H,23,24)