(2-nitro-5-propan-2-yl-phenyl) ethanoate

Systemtic Name: (2-nitro-5-propan-2-yl-phenyl) ethanoate Openeye Name: (5-isopropyl-2-nitro-phenyl) acetate CAS Name: acetic acid (2-nitro-5-propan-2-ylphenyl) ester IUPAC Name: (2-nitro-5-propan-2-ylphenyl) acetate Traditional Name: acetic acid (5-isopropyl-2-nitro-phenyl) ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4/c1-7(2)9-4-5-10(12(14)15)11(6-9)16-8(3)13/h4-7H,1-3H3