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

Systemtic Name: 3-decoxy-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-[(2-methylpropan-2-yl)oxy]chromen-2-one Openeye Name: 8-tert-butoxy-3-decoxy-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]chromen-2-one CAS Name: 3-decoxy-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-[(2-methylpropan-2-yl)oxy]-1-benzopyran-2-one IUPAC Name: 3-decoxy-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-8-[(2-methylpropan-2-yl)oxy]chromen-2-one Traditional Name: 8-tert-butoxy-3-decoxy-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]coumarin Formula: C33H50O5 MolecularWeight: 526.7471

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C2=C(C(=CC=C2)OC(C)(C)C)OC1=O)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCCCOC1=C(C2=C(C(=CC=C2)OC(C)(C)C)OC1=O)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C33H50O5/c1-8-9-10-11-12-13-14-15-23-35-31-30(36-24-22-26(4)19-16-18-25(2)3)27-20-17-21-28(38-33(5,6)7)29(27)37-32(31)34/h17-18,20-22H,8-16,19,23-24H2,1-7H3/b26-22+