2-(4-methanoyl-3,6-dimethyl-2-nitro-phenoxy)ethanoic acid

Systemtic Name: 2-(4-methanoyl-3,6-dimethyl-2-nitro-phenoxy)ethanoic acid Openeye Name: 2-(4-formyl-3,6-dimethyl-2-nitro-phenoxy)acetic acid CAS Name: 2-(4-formyl-3,6-dimethyl-2-nitrophenoxy)acetic acid IUPAC Name: 2-(4-formyl-3,6-dimethyl-2-nitrophenoxy)acetic acid Traditional Name: 2-(4-formyl-3,6-dimethyl-2-nitro-phenoxy)acetic acid Formula: C11H11NO6 MolecularWeight: 253.20814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO6/c1-6-3-8(4-13)7(2)10(12(16)17)11(6)18-5-9(14)15/h3-4H,5H2,1-2H3,(H,14,15)