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

Systemtic Name: ethyl (E)-6-cyano-7-(2-hydroxyphenyl)-4-methoxy-3,7-bis(oxidanylidene)hept-5-enoate Openeye Name: ethyl (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 ethyl ester IUPAC Name: ethyl (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 ethyl ester Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO6/c1-3-24-16(21)9-14(20)15(23-2)8-11(10-18)17(22)12-6-4-5-7-13(12)19/h4-8,15,19H,3,9H2,1-2H3/b11-8+