2-[(E)-2-[4-(cyanomethoxy)phenyl]ethenyl]quinoline-4-carboxylate

Systemtic Name: 2-[(E)-2-[4-(cyanomethoxy)phenyl]ethenyl]quinoline-4-carboxylate Openeye Name: 2-[(E)-2-[4-(cyanomethoxy)phenyl]vinyl]quinoline-4-carboxylate CAS Name: 2-[(E)-2-[4-(cyanomethoxy)phenyl]ethenyl]-4-quinolinecarboxylate IUPAC Name: 2-[(E)-2-[4-(cyanomethoxy)phenyl]ethenyl]quinoline-4-carboxylate Traditional Name: 2-[(E)-2-[4-(cyanomethoxy)phenyl]vinyl]cinchoninate Formula: C20H13N2O3- MolecularWeight: 329.32882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C=CC3=CC=C(C=C3)OCC#N)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)/C=C/C3=CC=C(C=C3)OCC#N)C(=O)[O-]

InChI

InChI=1S/C20H14N2O3/c21-11-12-25-16-9-6-14(7-10-16)5-8-15-13-18(20(23)24)17-3-1-2-4-19(17)22-15/h1-10,13H,12H2,(H,23,24)/p-1/b8-5+