2-methyl-2-(4-methylpent-3-enyl)-5-oxidanyl-7-pentyl-chromene-6-carboxylate

Systemtic Name: 2-methyl-2-(4-methylpent-3-enyl)-5-oxidanyl-7-pentyl-chromene-6-carboxylate Openeye Name: 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-chromene-6-carboxylate CAS Name: 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-1-benzopyran-6-carboxylate IUPAC Name: 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentylchromene-6-carboxylate Traditional Name: 7-amyl-5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)chromene-6-carboxylate Formula: C22H29O4- MolecularWeight: 357.46326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=CC(O2)(C)CCC=C(C)C)C(=C1C(=O)[O-])O

Isomeric SMILES

CCCCCC1=CC2=C(C=CC(O2)(C)CCC=C(C)C)C(=C1C(=O)[O-])O

InChI

InChI=1S/C22H30O4/c1-5-6-7-10-16-14-18-17(20(23)19(16)21(24)25)11-13-22(4,26-18)12-8-9-15(2)3/h9,11,13-14,23H,5-8,10,12H2,1-4H3,(H,24,25)/p-1