3-butyl-2-[2-(5-methylfuran-2-yl)cyclopropyl]-4-oxidanylidene-chromene-6-carboxylic acid

Systemtic Name: 3-butyl-2-[2-(5-methylfuran-2-yl)cyclopropyl]-4-oxidanylidene-chromene-6-carboxylic acid Openeye Name: 3-butyl-2-[2-(5-methyl-2-furyl)cyclopropyl]-4-oxo-chromene-6-carboxylic acid CAS Name: 3-butyl-2-[2-(5-methyl-2-furanyl)cyclopropyl]-4-oxo-1-benzopyran-6-carboxylic acid IUPAC Name: 3-butyl-2-[2-(5-methylfuran-2-yl)cyclopropyl]-4-oxochromene-6-carboxylic acid Traditional Name: 3-butyl-4-keto-2-[2-(5-methyl-2-furyl)cyclopropyl]chromene-6-carboxylic acid Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)C3CC3C4=CC=C(O4)C

Isomeric SMILES

CCCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)O)C3CC3C4=CC=C(O4)C

InChI

InChI=1S/C22H22O5/c1-3-4-5-14-20(23)17-10-13(22(24)25)7-9-19(17)27-21(14)16-11-15(16)18-8-6-12(2)26-18/h6-10,15-16H,3-5,11H2,1-2H3,(H,24,25)