[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 5-chloranyl-2-nitro-benzoate

Systemtic Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 5-chloranyl-2-nitro-benzoate Openeye Name: (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl 5-chloro-2-nitro-benzoate CAS Name: 5-chloro-2-nitrobenzoic acid [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 5-chloro-2-nitrobenzoate Traditional Name: 5-chloro-2-nitro-benzoic acid (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C14H14ClN3O5 MolecularWeight: 339.73106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H14ClN3O5/c1-8(2)5-12-16-13(23-17-12)7-22-14(19)10-6-9(15)3-4-11(10)18(20)21/h3-4,6,8H,5,7H2,1-2H3