methyl (E)-6-cyano-7-(2-hydroxyphenyl)-4-methoxy-3,7-bis(oxidanylidene)hept-5-enoate

Systemtic Name: methyl (E)-6-cyano-7-(2-hydroxyphenyl)-4-methoxy-3,7-bis(oxidanylidene)hept-5-enoate Openeye Name: methyl (E)-6-cyano-7-(2-hydroxyphenyl)-4-methoxy-3,7-dioxo-hept-5-enoate CAS Name: (E)-6-cyano-7-(2-hydroxyphenyl)-4-methoxy-3,7-dioxo-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-6-cyano-7-(2-hydroxyphenyl)-4-methoxy-3,7-dioxohept-5-enoate Traditional Name: (E)-6-cyano-7-(2-hydroxyphenyl)-3,7-diketo-4-methoxy-hept-5-enoic acid methyl ester Formula: C16H15NO6 MolecularWeight: 317.2934

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Descriptors Computed from Structure

Canonical SMILES:

COC(C=C(C#N)C(=O)C1=CC=CC=C1O)C(=O)CC(=O)OC

Isomeric SMILES

COC(/C=C(\C#N)/C(=O)C1=CC=CC=C1O)C(=O)CC(=O)OC

InChI

InChI=1S/C16H15NO6/c1-22-14(13(19)8-15(20)23-2)7-10(9-17)16(21)11-5-3-4-6-12(11)18/h3-7,14,18H,8H2,1-2H3/b10-7+