(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-chloranyl-5-methoxy-4-propoxy-benzoate

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-chloranyl-5-methoxy-4-propoxy-benzoate Openeye Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-chloro-5-methoxy-4-propoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-propoxybenzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-chloro-5-methoxy-4-propoxybenzoate Traditional Name: 3-chloro-5-methoxy-4-propoxy-benzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C20H19ClN2O5 MolecularWeight: 402.82826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)OCC2=NN=C(O2)C3=CC=CC=C3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)OCC2=NN=C(O2)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H19ClN2O5/c1-3-9-26-18-15(21)10-14(11-16(18)25-2)20(24)27-12-17-22-23-19(28-17)13-7-5-4-6-8-13/h4-8,10-11H,3,9,12H2,1-2H3