[2-[(E)-2-isoquinolin-3-ylethanoyloxyiminomethyl]phenyl] (E)-3-methoxyprop-2-enoate

Systemtic Name: [2-[(E)-2-isoquinolin-3-ylethanoyloxyiminomethyl]phenyl] (E)-3-methoxyprop-2-enoate Openeye Name: [2-[(E)-[2-(3-isoquinolyl)acetyl]oxyiminomethyl]phenyl] (E)-3-methoxyprop-2-enoate CAS Name: (E)-3-methoxy-2-propenoic acid [2-[(E)-[2-(3-isoquinolinyl)-1-oxoethoxy]iminomethyl]phenyl] ester IUPAC Name: [2-[(E)-(2-isoquinolin-3-ylacetyl)oxyiminomethyl]phenyl] (E)-3-methoxyprop-2-enoate Traditional Name: (E)-3-methoxyacrylic acid [2-[(E)-[2-(3-isoquinolyl)acetyl]oximinomethyl]phenyl] ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

COC=CC(=O)OC1=CC=CC=C1C=NOC(=O)CC2=CC3=CC=CC=C3C=N2

Isomeric SMILES

CO/C=C/C(=O)OC1=CC=CC=C1/C=N/OC(=O)CC2=CC3=CC=CC=C3C=N2

InChI

InChI=1S/C22H18N2O5/c1-27-11-10-21(25)28-20-9-5-4-8-18(20)15-24-29-22(26)13-19-12-16-6-2-3-7-17(16)14-23-19/h2-12,14-15H,13H2,1H3/b11-10+,24-15+