2-[(E)-3-(4,5-dihydro-1,3-oxazol-2-yl)prop-1-enyl]-2-tridecyl-propane-1,3-diol

Systemtic Name: 2-[(E)-3-(4,5-dihydro-1,3-oxazol-2-yl)prop-1-enyl]-2-tridecyl-propane-1,3-diol Openeye Name: 2-[(E)-3-(4,5-dihydrooxazol-2-yl)prop-1-enyl]-2-tridecyl-propane-1,3-diol CAS Name: 2-[(E)-3-(4,5-dihydrooxazol-2-yl)prop-1-enyl]-2-tridecylpropane-1,3-diol IUPAC Name: 2-[(E)-3-(4,5-dihydro-1,3-oxazol-2-yl)prop-1-enyl]-2-tridecylpropane-1,3-diol Traditional Name: 2-[(E)-3-(2-oxazolin-2-yl)prop-1-enyl]-2-tridecyl-propane-1,3-diol Formula: C22H41NO3 MolecularWeight: 367.56584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CO)(CO)C=CCC1=NCCO1

Isomeric SMILES

CCCCCCCCCCCCCC(CO)(CO)/C=C/CC1=NCCO1

InChI

InChI=1S/C22H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-15-22(19-24,20-25)16-13-14-21-23-17-18-26-21/h13,16,24-25H,2-12,14-15,17-20H2,1H3/b16-13+