5-[(1R,2S)-2-methyl-1-oxidanyl-pentyl]-2-nonan-5-yl-benzene-1,3-diol

Systemtic Name: 5-[(1R,2S)-2-methyl-1-oxidanyl-pentyl]-2-nonan-5-yl-benzene-1,3-diol Openeye Name: 2-(1-butylpentyl)-5-[(1R,2S)-1-hydroxy-2-methyl-pentyl]benzene-1,3-diol CAS Name: 5-[(1R,2S)-1-hydroxy-2-methylpentyl]-2-nonan-5-ylbenzene-1,3-diol IUPAC Name: 5-[(1R,2S)-1-hydroxy-2-methylpentyl]-2-nonan-5-ylbenzene-1,3-diol Traditional Name: 2-(1-butylpentyl)-5-[(1R,2S)-1-hydroxy-2-methyl-pentyl]resorcinol Formula: C21H36O3 MolecularWeight: 336.50874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)C1=C(C=C(C=C1O)C(C(C)CCC)O)O

Isomeric SMILES

CCCCC(CCCC)C1=C(C=C(C=C1O)[C@@H]([C@@H](C)CCC)O)O

InChI

InChI=1S/C21H36O3/c1-5-8-11-16(12-9-6-2)20-18(22)13-17(14-19(20)23)21(24)15(4)10-7-3/h13-16,21-24H,5-12H2,1-4H3/t15-,21+/m0/s1