3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propyl (Z)-heptadec-8-enoate

Systemtic Name: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propyl (Z)-heptadec-8-enoate Openeye Name: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-benzofuran-5-yl]propyl (Z)-heptadec-8-enoate CAS Name: (Z)-8-heptadecenoic acid 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-5-benzofuranyl]propyl ester IUPAC Name: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propyl (Z)-heptadec-8-enoate Traditional Name: (Z)-heptadec-8-enoic acid 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-benzofuran-5-yl]propyl ester Formula: C36H48O6 MolecularWeight: 576.76272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(=O)OCCCC1=CC(=C2C(=C1)C=C(O2)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCC(=O)OCCCC1=CC(=C2C(=C1)C=C(O2)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C36H48O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-35(37)39-22-17-18-28-23-30-26-32(42-36(30)34(24-28)38-2)29-20-21-31-33(25-29)41-27-40-31/h10-11,20-21,23-26H,3-9,12-19,22,27H2,1-2H3/b11-10-