(Z)-2-cyano-1-ethoxy-3-(2-fluorophenyl)-5-oxidanylidene-5-phenylazanyl-4-pyridin-1-ium-1-yl-pent-1-en-1-olate

Systemtic Name: (Z)-2-cyano-1-ethoxy-3-(2-fluorophenyl)-5-oxidanylidene-5-phenylazanyl-4-pyridin-1-ium-1-yl-pent-1-en-1-olate Openeye Name: (Z)-5-anilino-2-cyano-1-ethoxy-3-(2-fluorophenyl)-5-oxo-4-pyridin-1-ium-1-yl-pent-1-en-1-olate CAS Name: (Z)-5-anilino-2-cyano-1-ethoxy-3-(2-fluorophenyl)-5-oxo-4-(1-pyridin-1-iumyl)-1-penten-1-olate IUPAC Name: (Z)-5-anilino-2-cyano-1-ethoxy-3-(2-fluorophenyl)-5-oxo-4-pyridin-1-ium-1-ylpent-1-en-1-olate Traditional Name: (Z)-5-anilino-2-cyano-1-ethoxy-3-(2-fluorophenyl)-5-keto-4-pyridin-1-ium-1-yl-pent-1-en-1-olate Formula: C25H22FN3O3 MolecularWeight: 431.458883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C(C1=CC=CC=C1F)C(C(=O)NC2=CC=CC=C2)[N+]3=CC=CC=C3)[O-]

Isomeric SMILES

CCO/C(=C(\C#N)/C(C1=CC=CC=C1F)C(C(=O)NC2=CC=CC=C2)[N+]3=CC=CC=C3)/[O-]

InChI

InChI=1S/C25H22FN3O3/c1-2-32-25(31)20(17-27)22(19-13-7-8-14-21(19)26)23(29-15-9-4-10-16-29)24(30)28-18-11-5-3-6-12-18/h3-16,22-23H,2H2,1H3,(H-,28,30,31)/b25-20+