(3-heptyl-9-oxidanylidene-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-1-yl) ethanoate

Systemtic Name: (3-heptyl-9-oxidanylidene-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-1-yl) ethanoate Openeye Name: (3-heptyl-9-oxo-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-1-yl) acetate CAS Name: acetic acid (3-heptyl-9-oxo-6,6a,7,8,10,10a-hexahydrobenzo[c][1]benzopyran-1-yl) ester IUPAC Name: (3-heptyl-9-oxo-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-1-yl) acetate Traditional Name: acetic acid (3-heptyl-9-keto-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-1-yl) ester Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=C(C3CC(=O)CCC3CO2)C(=C1)OC(=O)C

Isomeric SMILES

CCCCCCCC1=CC2=C(C3CC(=O)CCC3CO2)C(=C1)OC(=O)C

InChI

InChI=1S/C22H30O4/c1-3-4-5-6-7-8-16-11-20-22(21(12-16)26-15(2)23)19-13-18(24)10-9-17(19)14-25-20/h11-12,17,19H,3-10,13-14H2,1-2H3