3-butyl-4-oxidanylidene-2-(2-pyridin-2-ylcyclopropyl)chromene-6-carboxylic acid

Systemtic Name: 3-butyl-4-oxidanylidene-2-(2-pyridin-2-ylcyclopropyl)chromene-6-carboxylic acid Openeye Name: 3-butyl-4-oxo-2-[2-(2-pyridyl)cyclopropyl]chromene-6-carboxylic acid CAS Name: 3-butyl-4-oxo-2-[2-(2-pyridinyl)cyclopropyl]-1-benzopyran-6-carboxylic acid IUPAC Name: 3-butyl-4-oxo-2-(2-pyridin-2-ylcyclopropyl)chromene-6-carboxylic acid Traditional Name: 3-butyl-4-keto-2-[2-(2-pyridyl)cyclopropyl]chromene-6-carboxylic acid Formula: C22H21NO4 MolecularWeight: 363.40644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)C3CC3C4=CC=CC=N4

Isomeric SMILES

CCCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)C3CC3C4=CC=CC=N4

InChI

InChI=1S/C22H21NO4/c1-2-3-6-14-20(24)17-11-13(22(25)26)8-9-19(17)27-21(14)16-12-15(16)18-7-4-5-10-23-18/h4-5,7-11,15-16H,2-3,6,12H2,1H3,(H,25,26)