(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-[(2-nitrophenyl)amino]butanoate

Systemtic Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-[(2-nitrophenyl)amino]butanoate Openeye Name: (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl 4-(2-nitroanilino)butanoate CAS Name: 4-(2-nitroanilino)butanoic acid (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(2-nitroanilino)butanoate Traditional Name: 4-(2-nitroanilino)butyric acid (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C16H20N4O5 MolecularWeight: 348.3538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)COC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NOC(=N1)COC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O5/c1-11(2)16-18-14(25-19-16)10-24-15(21)8-5-9-17-12-6-3-4-7-13(12)20(22)23/h3-4,6-7,11,17H,5,8-10H2,1-2H3