[4-[(E)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 2-(2-prop-2-enylphenoxy)ethanoate

Systemtic Name: [4-[(E)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 2-(2-prop-2-enylphenoxy)ethanoate Openeye Name: [4-[(E)-3-amino-2-cyano-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 2-(2-allylphenoxy)acetate CAS Name: 2-(2-prop-2-enylphenoxy)acetic acid [4-[(E)-3-amino-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-3-amino-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenyl] 2-(2-prop-2-enylphenoxy)acetate Traditional Name: 2-(2-allylphenoxy)acetic acid [4-[(E)-3-amino-2-cyano-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)N)OC(=O)COC2=CC=CC=C2CC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)N)OC(=O)COC2=CC=CC=C2CC=C

InChI

InChI=1S/C22H20N2O5/c1-3-6-16-7-4-5-8-18(16)28-14-21(25)29-19-10-9-15(12-20(19)27-2)11-17(13-23)22(24)26/h3-5,7-12H,1,6,14H2,2H3,(H2,24,26)/b17-11+