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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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