ethyl 4-[[3-methyl-3-(2-nitro-4-oxidanyl-phenyl)butanoyl]amino]butanoate

Systemtic Name: ethyl 4-[[3-methyl-3-(2-nitro-4-oxidanyl-phenyl)butanoyl]amino]butanoate Openeye Name: ethyl 4-[[3-(4-hydroxy-2-nitro-phenyl)-3-methyl-butanoyl]amino]butanoate CAS Name: 4-[[3-(4-hydroxy-2-nitrophenyl)-3-methyl-1-oxobutyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-hydroxy-2-nitrophenyl)-3-methylbutanoyl]amino]butanoate Traditional Name: 4-[[3-(4-hydroxy-2-nitro-phenyl)-3-methyl-butanoyl]amino]butyric acid ethyl ester Formula: C17H24N2O6 MolecularWeight: 352.38226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CC(C)(C)C1=C(C=C(C=C1)O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCNC(=O)CC(C)(C)C1=C(C=C(C=C1)O)[N+](=O)[O-]

InChI

InChI=1S/C17H24N2O6/c1-4-25-16(22)6-5-9-18-15(21)11-17(2,3)13-8-7-12(20)10-14(13)19(23)24/h7-8,10,20H,4-6,9,11H2,1-3H3,(H,18,21)