[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(3,4,5-trimethoxyphenyl)ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(3,4,5-trimethoxyphenyl)ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(3,4,5-trimethoxyphenyl)acetate CAS Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(3,4,5-trimethoxyphenyl)acetate Traditional Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CC1=CC(=C(C(=C1)OC)OC)OC)/N

InChI

InChI=1S/C17H20N2O6/c1-10(19)12(8-18)13(20)9-25-16(21)7-11-5-14(22-2)17(24-4)15(6-11)23-3/h5-6H,7,9,19H2,1-4H3/b12-10+