methyl (2R)-2-cyano-3-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: methyl (2R)-2-cyano-3-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl (2R)-2-cyano-3-(4,4-dimethyl-2,6-dioxo-cyclohexylidene)-3-(4-hydroxyphenyl)propanoate CAS Name: (2R)-2-cyano-3-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-cyano-3-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-(4-hydroxyphenyl)propanoate Traditional Name: (2R)-2-cyano-3-(2,6-diketo-4,4-dimethyl-cyclohexylidene)-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C(C2=CC=C(C=C2)O)C(C#N)C(=O)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=C(C2=CC=C(C=C2)O)[C@H](C#N)C(=O)OC)C(=O)C1)C

InChI

InChI=1S/C19H19NO5/c1-19(2)8-14(22)17(15(23)9-19)16(13(10-20)18(24)25-3)11-4-6-12(21)7-5-11/h4-7,13,21H,8-9H2,1-3H3/t13-/m0/s1