3-[5,6-bis(4-methoxyphenyl)-2-oxidanylidene-1H-pyrazin-3-yl]propanoic acid

Systemtic Name: 3-[5,6-bis(4-methoxyphenyl)-2-oxidanylidene-1H-pyrazin-3-yl]propanoic acid Openeye Name: 3-[5,6-bis(4-methoxyphenyl)-2-oxo-1H-pyrazin-3-yl]propanoic acid CAS Name: 3-[5,6-bis(4-methoxyphenyl)-2-oxo-1H-pyrazin-3-yl]propanoic acid IUPAC Name: 3-[5,6-bis(4-methoxyphenyl)-2-oxo-1H-pyrazin-3-yl]propanoic acid Traditional Name: 3-[2-keto-5,6-bis(4-methoxyphenyl)-1H-pyrazin-3-yl]propionic acid Formula: C21H20N2O5 MolecularWeight: 380.3939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N=C(C(=O)N2)CCC(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N=C(C(=O)N2)CCC(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H20N2O5/c1-27-15-7-3-13(4-8-15)19-20(14-5-9-16(28-2)10-6-14)23-21(26)17(22-19)11-12-18(24)25/h3-10H,11-12H2,1-2H3,(H,23,26)(H,24,25)