2-[(1R,2R,5R)-5-oxidanyl-2-[(E)-4-oxidanylbut-2-en-2-yl]cyclohexyl]-5-pentyl-benzene-1,3-diol

Systemtic Name: 2-[(1R,2R,5R)-5-oxidanyl-2-[(E)-4-oxidanylbut-2-en-2-yl]cyclohexyl]-5-pentyl-benzene-1,3-diol Openeye Name: 2-[(1R,2R,5R)-5-hydroxy-2-[(E)-3-hydroxy-1-methyl-prop-1-enyl]cyclohexyl]-5-pentyl-benzene-1,3-diol CAS Name: 2-[(1R,2R,5R)-5-hydroxy-2-[(E)-4-hydroxybut-2-en-2-yl]cyclohexyl]-5-pentylbenzene-1,3-diol IUPAC Name: 2-[(1R,2R,5R)-5-hydroxy-2-[(E)-4-hydroxybut-2-en-2-yl]cyclohexyl]-5-pentylbenzene-1,3-diol Traditional Name: 5-amyl-2-[(1R,2R,5R)-5-hydroxy-2-[(E)-3-hydroxy-1-methyl-prop-1-enyl]cyclohexyl]resorcinol Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1)O)C2CC(CCC2C(=CCO)C)O)O

Isomeric SMILES

CCCCCC1=CC(=C(C(=C1)O)[C@@H]2C[C@@H](CC[C@H]2/C(=C/CO)/C)O)O

InChI

InChI=1S/C21H32O4/c1-3-4-5-6-15-11-19(24)21(20(25)12-15)18-13-16(23)7-8-17(18)14(2)9-10-22/h9,11-12,16-18,22-25H,3-8,10,13H2,1-2H3/b14-9+/t16-,17+,18-/m1/s1