4-[4-(1-cyano-2-octoxy-2-oxidanylidene-ethylidene)pyridin-1-yl]benzoic acid

Systemtic Name: 4-[4-(1-cyano-2-octoxy-2-oxidanylidene-ethylidene)pyridin-1-yl]benzoic acid Openeye Name: 4-[4-(1-cyano-2-octoxy-2-oxo-ethylidene)-1-pyridyl]benzoic acid CAS Name: 4-[4-(1-cyano-2-octoxy-2-oxoethylidene)-1-pyridinyl]benzoic acid IUPAC Name: 4-[4-(1-cyano-2-octoxy-2-oxoethylidene)pyridin-1-yl]benzoic acid Traditional Name: 4-[4-(1-cyano-2-keto-2-octoxy-ethylidene)-1-pyridyl]benzoic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(=C1C=CN(C=C1)C2=CC=C(C=C2)C(=O)O)C#N

Isomeric SMILES

CCCCCCCCOC(=O)C(=C1C=CN(C=C1)C2=CC=C(C=C2)C(=O)O)C#N

InChI

InChI=1S/C23H26N2O4/c1-2-3-4-5-6-7-16-29-23(28)21(17-24)18-12-14-25(15-13-18)20-10-8-19(9-11-20)22(26)27/h8-15H,2-7,16H2,1H3,(H,26,27)