7-octoxy-4-oxidanylidene-3-pyridin-2-yl-chromene-2-carboxylic acid

Systemtic Name: 7-octoxy-4-oxidanylidene-3-pyridin-2-yl-chromene-2-carboxylic acid Openeye Name: 7-octoxy-4-oxo-3-(2-pyridyl)chromene-2-carboxylic acid CAS Name: 7-octoxy-4-oxo-3-(2-pyridinyl)-1-benzopyran-2-carboxylic acid IUPAC Name: 7-octoxy-4-oxo-3-pyridin-2-ylchromene-2-carboxylic acid Traditional Name: 4-keto-7-octoxy-3-(2-pyridyl)chromene-2-carboxylic acid Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(=O)O)C3=CC=CC=N3

Isomeric SMILES

CCCCCCCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(=O)O)C3=CC=CC=N3

InChI

InChI=1S/C23H25NO5/c1-2-3-4-5-6-9-14-28-16-11-12-17-19(15-16)29-22(23(26)27)20(21(17)25)18-10-7-8-13-24-18/h7-8,10-13,15H,2-6,9,14H2,1H3,(H,26,27)