N-butyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitro-aniline

Systemtic Name: N-butyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitro-aniline Openeye Name: N-butyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitro-aniline CAS Name: N-butyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitroaniline IUPAC Name: N-butyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitroaniline Traditional Name: butyl-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-nitro-phenyl]amine Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)C2=NC(=NO2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)C2=NC(=NO2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O3/c1-3-4-7-14-11-6-5-10(8-12(11)17(18)19)13-15-9(2)16-20-13/h5-6,8,14H,3-4,7H2,1-2H3