6-hexyl-7-methoxy-2-oxidanylidene-chromene-3-carboxylic acid

Systemtic Name: 6-hexyl-7-methoxy-2-oxidanylidene-chromene-3-carboxylic acid Openeye Name: 6-hexyl-7-methoxy-2-oxo-chromene-3-carboxylic acid CAS Name: 6-hexyl-7-methoxy-2-oxo-1-benzopyran-3-carboxylic acid IUPAC Name: 6-hexyl-7-methoxy-2-oxochromene-3-carboxylic acid Traditional Name: 6-hexyl-2-keto-7-methoxy-chromene-3-carboxylic acid Formula: C17H20O5 MolecularWeight: 304.3377

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C(=O)O)OC

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C(=O)O)OC

InChI

InChI=1S/C17H20O5/c1-3-4-5-6-7-11-8-12-9-13(16(18)19)17(20)22-15(12)10-14(11)21-2/h8-10H,3-7H2,1-2H3,(H,18,19)