2-ethyl-4-[3-(6-methyl-6-oxidanyl-heptyl)phenyl]benzene-1,3-diol

Systemtic Name: 2-ethyl-4-[3-(6-methyl-6-oxidanyl-heptyl)phenyl]benzene-1,3-diol Openeye Name: 2-ethyl-4-[3-(6-hydroxy-6-methyl-heptyl)phenyl]benzene-1,3-diol CAS Name: 2-ethyl-4-[3-(6-hydroxy-6-methylheptyl)phenyl]benzene-1,3-diol IUPAC Name: 2-ethyl-4-[3-(6-hydroxy-6-methylheptyl)phenyl]benzene-1,3-diol Traditional Name: 2-ethyl-4-[3-(6-hydroxy-6-methyl-heptyl)phenyl]resorcinol Formula: C22H30O3 MolecularWeight: 342.4718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1O)C2=CC(=CC=C2)CCCCCC(C)(C)O)O

Isomeric SMILES

CCC1=C(C=CC(=C1O)C2=CC(=CC=C2)CCCCCC(C)(C)O)O

InChI

InChI=1S/C22H30O3/c1-4-18-20(23)13-12-19(21(18)24)17-11-8-10-16(15-17)9-6-5-7-14-22(2,3)25/h8,10-13,15,23-25H,4-7,9,14H2,1-3H3