3-[[6-(3-ethylpentoxy)hexylamino]methyl]-2,4-bis(hydroxymethyl)phenol

Systemtic Name: 3-[[6-(3-ethylpentoxy)hexylamino]methyl]-2,4-bis(hydroxymethyl)phenol Openeye Name: 3-[[6-(3-ethylpentoxy)hexylamino]methyl]-2,4-bis(hydroxymethyl)phenol CAS Name: 3-[[6-(3-ethylpentoxy)hexylamino]methyl]-2,4-bis(hydroxymethyl)phenol IUPAC Name: 3-[[6-(3-ethylpentoxy)hexylamino]methyl]-2,4-bis(hydroxymethyl)phenol Traditional Name: 3-[[6-(3-ethylpentoxy)hexylamino]methyl]-2,4-dimethylol-phenol Formula: C22H39NO4 MolecularWeight: 381.54936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CCOCCCCCCNCC1=C(C=CC(=C1CO)O)CO

Isomeric SMILES

CCC(CC)CCOCCCCCCNCC1=C(C=CC(=C1CO)O)CO

InChI

InChI=1S/C22H39NO4/c1-3-18(4-2)11-14-27-13-8-6-5-7-12-23-15-20-19(16-24)9-10-22(26)21(20)17-25/h9-10,18,23-26H,3-8,11-17H2,1-2H3