1-(hexan-3-ylamino)heptane-2,3-diol

Systemtic Name: 1-(hexan-3-ylamino)heptane-2,3-diol Openeye Name: 1-(1-ethylbutylamino)heptane-2,3-diol CAS Name: 1-(hexan-3-ylamino)heptane-2,3-diol IUPAC Name: 1-(hexan-3-ylamino)heptane-2,3-diol Traditional Name: 1-(1-ethylbutylamino)heptane-2,3-diol Formula: C13H29NO2 MolecularWeight: 231.37486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CNC(CC)CCC)O)O

Isomeric SMILES

CCCCC(C(CNC(CC)CCC)O)O

InChI

InChI=1S/C13H29NO2/c1-4-7-9-12(15)13(16)10-14-11(6-3)8-5-2/h11-16H,4-10H2,1-3H3