3-(2-methylheptan-2-yl)-1-oxidanyl-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-9-one

Systemtic Name: 3-(2-methylheptan-2-yl)-1-oxidanyl-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-9-one Openeye Name: 3-(1,1-dimethylhexyl)-1-hydroxy-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-9-one CAS Name: 1-hydroxy-3-(2-methylheptan-2-yl)-6,6a,7,8,10,10a-hexahydrobenzo[c][1]benzopyran-9-one IUPAC Name: 1-hydroxy-3-(2-methylheptan-2-yl)-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-9-one Traditional Name: 3-(1,1-dimethylhexyl)-1-hydroxy-6,6a,7,8,10,10a-hexahydrobenzo[c]chromen-9-one Formula: C21H30O3 MolecularWeight: 330.4611

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CC2=C(C3CC(=O)CCC3CO2)C(=C1)O

Isomeric SMILES

CCCCCC(C)(C)C1=CC2=C(C3CC(=O)CCC3CO2)C(=C1)O

InChI

InChI=1S/C21H30O3/c1-4-5-6-9-21(2,3)15-10-18(23)20-17-12-16(22)8-7-14(17)13-24-19(20)11-15/h10-11,14,17,23H,4-9,12-13H2,1-3H3