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

Systemtic Name: 4-decoxy-8-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-[(E)-hex-3-enoxy]chromen-2-one Openeye Name: 4-decoxy-8-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-[(E)-hex-3-enoxy]chromen-2-one CAS Name: 4-decoxy-8-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-[(E)-hex-3-enoxy]-1-benzopyran-2-one IUPAC Name: 4-decoxy-8-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-[(E)-hex-3-enoxy]chromen-2-one Traditional Name: 4-decoxy-8-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-[(E)-hex-3-enoxy]coumarin Formula: C35H52O5 MolecularWeight: 552.78438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C(=O)OC2=C1C=CC=C2OCC=C(C)CCC=C(C)C)OCCC=CCC

Isomeric SMILES

CCCCCCCCCCOC1=C(C(=O)OC2=C1C=CC=C2OC/C=C(\C)/CCC=C(C)C)OCC/C=C/CC

InChI

InChI=1S/C35H52O5/c1-6-8-10-12-13-14-15-17-25-38-33-30-22-19-23-31(37-27-24-29(5)21-18-20-28(3)4)32(30)40-35(36)34(33)39-26-16-11-9-7-2/h9,11,19-20,22-24H,6-8,10,12-18,21,25-27H2,1-5H3/b11-9+,29-24+