(4-cyano-2-methoxy-phenyl) 3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: (4-cyano-2-methoxy-phenyl) 3-(5-methyl-1,3-dioxo-isoindolin-2-yl)propanoate CAS Name: 3-(5-methyl-1,3-dioxo-2-isoindolyl)propanoic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 3-(5-methyl-1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-(1,3-diketo-5-methyl-isoindolin-2-yl)propionic acid (4-cyano-2-methoxy-phenyl) ester Formula: C20H16N2O5 MolecularWeight: 364.35144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)OC3=C(C=C(C=C3)C#N)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)OC3=C(C=C(C=C3)C#N)OC

InChI

InChI=1S/C20H16N2O5/c1-12-3-5-14-15(9-12)20(25)22(19(14)24)8-7-18(23)27-16-6-4-13(11-21)10-17(16)26-2/h3-6,9-10H,7-8H2,1-2H3