[6-heptyl-8-methyl-2-(3-methylbutanoyl)-12-oxidanylidene-10H-benzo[b][1,5]benzodioxocin-1-yl] methanoate

Systemtic Name: [6-heptyl-8-methyl-2-(3-methylbutanoyl)-12-oxidanylidene-10H-benzo[b][1,5]benzodioxocin-1-yl] methanoate Openeye Name: [6-heptyl-8-methyl-2-(3-methylbutanoyl)-12-oxo-10H-benzo[b][1,5]benzodioxocin-1-yl] formate CAS Name: formic acid [6-heptyl-8-methyl-2-(3-methyl-1-oxobutyl)-12-oxo-10H-benzo[b][1,5]benzodioxocin-1-yl] ester IUPAC Name: [6-heptyl-8-methyl-2-(3-methylbutanoyl)-12-oxo-10H-benzo[b][1,5]benzodioxocin-1-yl] formate Traditional Name: formic acid (6-heptyl-2-isovaleryl-12-keto-8-methyl-10H-benzo[b][1,5]benzodioxocin-1-yl) ester Formula: C28H34O6 MolecularWeight: 466.56596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C2C(=CC(=C1)C)COC(=O)C3=C(O2)C=CC(=C3OC=O)C(=O)CC(C)C

Isomeric SMILES

CCCCCCCC1=C2C(=CC(=C1)C)COC(=O)C3=C(O2)C=CC(=C3OC=O)C(=O)CC(C)C

InChI

InChI=1S/C28H34O6/c1-5-6-7-8-9-10-20-14-19(4)15-21-16-32-28(31)25-24(34-26(20)21)12-11-22(27(25)33-17-29)23(30)13-18(2)3/h11-12,14-15,17-18H,5-10,13,16H2,1-4H3