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

Systemtic Name: (Z)-2-cyano-1-ethoxy-5-oxidanylidene-3-phenyl-5-phenylazanyl-4-pyridin-1-ium-1-yl-pent-1-en-1-olate Openeye Name: (Z)-5-anilino-2-cyano-1-ethoxy-5-oxo-3-phenyl-4-pyridin-1-ium-1-yl-pent-1-en-1-olate CAS Name: (Z)-5-anilino-2-cyano-1-ethoxy-5-oxo-3-phenyl-4-(1-pyridin-1-iumyl)-1-penten-1-olate IUPAC Name: (Z)-5-anilino-2-cyano-1-ethoxy-5-oxo-3-phenyl-4-pyridin-1-ium-1-ylpent-1-en-1-olate Traditional Name: (Z)-5-anilino-2-cyano-1-ethoxy-5-keto-3-phenyl-4-pyridin-1-ium-1-yl-pent-1-en-1-olate Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O3/c1-2-31-25(30)21(18-26)22(19-12-6-3-7-13-19)23(28-16-10-5-11-17-28)24(29)27-20-14-8-4-9-15-20/h3-17,22-23H,2H2,1H3,(H-,27,29,30)/b25-21+