1-hexyl-4-oxidanylidene-2,6-diphenyl-pyridine-3-carboxylic acid

Systemtic Name: 1-hexyl-4-oxidanylidene-2,6-diphenyl-pyridine-3-carboxylic acid Openeye Name: 1-hexyl-4-oxo-2,6-diphenyl-pyridine-3-carboxylic acid CAS Name: 1-hexyl-4-oxo-2,6-diphenyl-3-pyridinecarboxylic acid IUPAC Name: 1-hexyl-4-oxo-2,6-diphenylpyridine-3-carboxylic acid Traditional Name: 1-hexyl-4-keto-2,6-diphenyl-nicotinic acid Formula: C24H25NO3 MolecularWeight: 375.4602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=CC(=O)C(=C1C2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCN1C(=CC(=O)C(=C1C2=CC=CC=C2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C24H25NO3/c1-2-3-4-11-16-25-20(18-12-7-5-8-13-18)17-21(26)22(24(27)28)23(25)19-14-9-6-10-15-19/h5-10,12-15,17H,2-4,11,16H2,1H3,(H,27,28)