2-azanyl-2-(hydroxymethyl)-4-(4-octylphenyl)butane-1,3-diol

Systemtic Name: 2-azanyl-2-(hydroxymethyl)-4-(4-octylphenyl)butane-1,3-diol Openeye Name: 2-amino-2-(hydroxymethyl)-4-(4-octylphenyl)butane-1,3-diol CAS Name: 2-amino-2-(hydroxymethyl)-4-(4-octylphenyl)butane-1,3-diol IUPAC Name: 2-amino-2-(hydroxymethyl)-4-(4-octylphenyl)butane-1,3-diol Traditional Name: 2-amino-2-methylol-4-(4-octylphenyl)butane-1,3-diol Formula: C19H33NO3 MolecularWeight: 323.47022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CC(C(CO)(CO)N)O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CC(C(CO)(CO)N)O

InChI

InChI=1S/C19H33NO3/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)13-18(23)19(20,14-21)15-22/h9-12,18,21-23H,2-8,13-15,20H2,1H3