[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: [2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [2-(4-methyl-2-nitro-anilino)-2-oxo-1-phenyl-ethyl] 3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoate CAS Name: 3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoic acid [2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methyl-2-nitroanilino)-2-oxo-1-phenylethyl] 3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)propionic acid [2-keto-2-(4-methyl-2-nitro-anilino)-1-phenyl-ethyl] ester Formula: C24H26N4O6 MolecularWeight: 466.48644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)CCC3=NC(=NO3)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)CCC3=NC(=NO3)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C24H26N4O6/c1-15-10-11-17(18(14-15)28(31)32)25-22(30)21(16-8-6-5-7-9-16)33-20(29)13-12-19-26-23(27-34-19)24(2,3)4/h5-11,14,21H,12-13H2,1-4H3,(H,25,30)