1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 3-chloranyl-5-methoxy-4-(3-methylbutoxy)benzoate

Systemtic Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 3-chloranyl-5-methoxy-4-(3-methylbutoxy)benzoate Openeye Name: 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl 3-chloro-4-isopentyloxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-(3-methylbutoxy)benzoic acid 1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 3-chloro-5-methoxy-4-(3-methylbutoxy)benzoate Traditional Name: 3-chloro-4-isoamoxy-5-methoxy-benzoic acid 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C22H24ClN3O5 MolecularWeight: 445.89606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1Cl)C(=O)OC(C)C2=NC(=NO2)C3=CN=CC=C3)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1Cl)C(=O)OC(C)C2=NC(=NO2)C3=CN=CC=C3)OC

InChI

InChI=1S/C22H24ClN3O5/c1-13(2)7-9-29-19-17(23)10-16(11-18(19)28-4)22(27)30-14(3)21-25-20(26-31-21)15-6-5-8-24-12-15/h5-6,8,10-14H,7,9H2,1-4H3