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

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-chloranyl-4-ethoxy-5-methoxy-benzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-chloro-4-ethoxy-5-methoxy-benzoate CAS Name: 3-chloro-4-ethoxy-5-methoxybenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 3-chloro-4-ethoxy-5-methoxybenzoate Traditional Name: 3-chloro-4-ethoxy-5-methoxy-benzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C19H17ClN2O5 MolecularWeight: 388.80168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)OCC2=NC(=NO2)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H17ClN2O5/c1-3-25-17-14(20)9-13(10-15(17)24-2)19(23)26-11-16-21-18(22-27-16)12-7-5-4-6-8-12/h4-10H,3,11H2,1-2H3