1-(4-methyl-2,6-dinitro-phenyl)azetidine-3-carboxylic acid

Systemtic Name: 1-(4-methyl-2,6-dinitro-phenyl)azetidine-3-carboxylic acid Openeye Name: 1-(4-methyl-2,6-dinitro-phenyl)azetidine-3-carboxylic acid CAS Name: 1-(4-methyl-2,6-dinitrophenyl)-3-azetidinecarboxylic acid IUPAC Name: 1-(4-methyl-2,6-dinitrophenyl)azetidine-3-carboxylic acid Traditional Name: 1-(4-methyl-2,6-dinitro-phenyl)azetidine-3-carboxylic acid Formula: C11H11N3O6 MolecularWeight: 281.22154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])N2CC(C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])N2CC(C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O6/c1-6-2-8(13(17)18)10(9(3-6)14(19)20)12-4-7(5-12)11(15)16/h2-3,7H,4-5H2,1H3,(H,15,16)