4-(2-methyl-5-nitro-phenoxy)butanoic acid

Systemtic Name: 4-(2-methyl-5-nitro-phenoxy)butanoic acid Openeye Name: 4-(2-methyl-5-nitro-phenoxy)butanoic acid CAS Name: 4-(2-methyl-5-nitrophenoxy)butanoic acid IUPAC Name: 4-(2-methyl-5-nitrophenoxy)butanoic acid Traditional Name: 4-(2-methyl-5-nitro-phenoxy)butyric acid Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])OCCCC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])OCCCC(=O)O

InChI

InChI=1S/C11H13NO5/c1-8-4-5-9(12(15)16)7-10(8)17-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14)