3-[4-(4-chloranylphenoxy)phenyl]-5-hexadecoxy-1,3,4-oxadiazol-2-one

Systemtic Name: 3-[4-(4-chloranylphenoxy)phenyl]-5-hexadecoxy-1,3,4-oxadiazol-2-one Openeye Name: 3-[4-(4-chlorophenoxy)phenyl]-5-hexadecoxy-1,3,4-oxadiazol-2-one CAS Name: 3-[4-(4-chlorophenoxy)phenyl]-5-hexadecoxy-1,3,4-oxadiazol-2-one IUPAC Name: 3-[4-(4-chlorophenoxy)phenyl]-5-hexadecoxy-1,3,4-oxadiazol-2-one Traditional Name: 5-cetyloxy-3-[4-(4-chlorophenoxy)phenyl]-1,3,4-oxadiazol-2-one Formula: C30H41ClN2O4 MolecularWeight: 529.11054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=NN(C(=O)O1)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=NN(C(=O)O1)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C30H41ClN2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-35-29-32-33(30(34)37-29)26-18-22-28(23-19-26)36-27-20-16-25(31)17-21-27/h16-23H,2-15,24H2,1H3