4-[(2-hexyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]-5-methyl-furan-2-carboxylic acid

Systemtic Name: 4-[(2-hexyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]-5-methyl-furan-2-carboxylic acid Openeye Name: 4-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]-5-methyl-furan-2-carboxylic acid CAS Name: 4-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-yl)oxymethyl]-5-methyl-2-furancarboxylic acid IUPAC Name: 4-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]-5-methylfuran-2-carboxylic acid Traditional Name: 4-[(2-hexyl-6-keto-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxymethyl]-5-methyl-2-furoic acid Formula: C26H30O6 MolecularWeight: 438.5128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C3=C(CCCC3)C(=O)O2)OCC4=C(OC(=C4)C(=O)O)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C3=C(CCCC3)C(=O)O2)OCC4=C(OC(=C4)C(=O)O)C

InChI

InChI=1S/C26H30O6/c1-3-4-5-6-9-17-12-21-19-10-7-8-11-20(19)26(29)32-23(21)14-22(17)30-15-18-13-24(25(27)28)31-16(18)2/h12-14H,3-11,15H2,1-2H3,(H,27,28)