ethyl 2-cyano-2-[3-methoxy-4,5-bis(oxidanyl)phenyl]-2-phenyl-ethanoate

Systemtic Name: ethyl 2-cyano-2-[3-methoxy-4,5-bis(oxidanyl)phenyl]-2-phenyl-ethanoate Openeye Name: ethyl 2-cyano-2-(3,4-dihydroxy-5-methoxy-phenyl)-2-phenyl-acetate CAS Name: 2-cyano-2-(3,4-dihydroxy-5-methoxyphenyl)-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(3,4-dihydroxy-5-methoxyphenyl)-2-phenylacetate Traditional Name: 2-cyano-2-(3,4-dihydroxy-5-methoxy-phenyl)-2-phenyl-acetic acid ethyl ester Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO5/c1-3-24-17(22)18(11-19,12-7-5-4-6-8-12)13-9-14(20)16(21)15(10-13)23-2/h4-10,20-21H,3H2,1-2H3