4-decoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-oxidanyl-chromen-2-one

Systemtic Name: 4-decoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-oxidanyl-chromen-2-one Openeye Name: 4-decoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-hydroxy-chromen-2-one CAS Name: 4-decoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-hydroxy-1-benzopyran-2-one IUPAC Name: 4-decoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-hydroxychromen-2-one Traditional Name: 4-decoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-hydroxy-coumarin Formula: C29H42O5 MolecularWeight: 470.64078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C(=O)OC2=C1C=CC=C2O)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCCCOC1=C(C(=O)OC2=C1C=CC=C2O)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C29H42O5/c1-5-6-7-8-9-10-11-12-20-32-27-24-17-14-18-25(30)26(24)34-29(31)28(27)33-21-19-23(4)16-13-15-22(2)3/h14-15,17-19,30H,5-13,16,20-21H2,1-4H3/b23-19+