methyl 3-cyano-5-[1-(3-cyano-4-methoxy-5-methoxycarbonyl-phenyl)-6-methoxy-6-oxidanylidene-hex-1-enyl]-2-methoxy-benzoate

Systemtic Name: methyl 3-cyano-5-[1-(3-cyano-4-methoxy-5-methoxycarbonyl-phenyl)-6-methoxy-6-oxidanylidene-hex-1-enyl]-2-methoxy-benzoate Openeye Name: methyl 3-cyano-5-[1-(3-cyano-4-methoxy-5-methoxycarbonyl-phenyl)-6-methoxy-6-oxo-hex-1-enyl]-2-methoxy-benzoate CAS Name: 3-cyano-5-[1-(3-cyano-4-methoxy-5-methoxycarbonylphenyl)-6-methoxy-6-oxohex-1-enyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-cyano-5-[1-(3-cyano-4-methoxy-5-methoxycarbonylphenyl)-6-methoxy-6-oxohex-1-enyl]-2-methoxybenzoate Traditional Name: 5-[1-(3-carbomethoxy-5-cyano-4-methoxy-phenyl)-6-keto-6-methoxy-hex-1-enyl]-3-cyano-2-methoxy-benzoic acid methyl ester Formula: C27H26N2O8 MolecularWeight: 506.50394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C#N)C(=CCCCC(=O)OC)C2=CC(=C(C(=C2)C#N)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1C#N)C(=CCCCC(=O)OC)C2=CC(=C(C(=C2)C#N)OC)C(=O)OC)C(=O)OC

InChI

InChI=1S/C27H26N2O8/c1-33-23(30)9-7-6-8-20(16-10-18(14-28)24(34-2)21(12-16)26(31)36-4)17-11-19(15-29)25(35-3)22(13-17)27(32)37-5/h8,10-13H,6-7,9H2,1-5H3