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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCCCCCCNCC1=C(C=CC(=C1CO)O)CO

Isomeric SMILES

CCCCCCCOCCCCCCNCC1=C(C=CC(=C1CO)O)CO

InChI

InChI=1S/C22H39NO4/c1-2-3-4-6-9-14-27-15-10-7-5-8-13-23-16-20-19(17-24)11-12-22(26)21(20)18-25/h11-12,23-26H,2-10,13-18H2,1H3