2-[4-(2-methylprop-2-enoxy)-3-nitro-phenyl]ethanoic acid

Systemtic Name: 2-[4-(2-methylprop-2-enoxy)-3-nitro-phenyl]ethanoic acid Openeye Name: 2-[4-(2-methylallyloxy)-3-nitro-phenyl]acetic acid CAS Name: 2-[4-(2-methylprop-2-enoxy)-3-nitrophenyl]acetic acid IUPAC Name: 2-[4-(2-methylprop-2-enoxy)-3-nitrophenyl]acetic acid Traditional Name: 2-[4-(2-methylallyloxy)-3-nitro-phenyl]acetic acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COC1=C(C=C(C=C1)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=C)COC1=C(C=C(C=C1)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H13NO5/c1-8(2)7-18-11-4-3-9(6-12(14)15)5-10(11)13(16)17/h3-5H,1,6-7H2,2H3,(H,14,15)