ethyl 3-nitro-4-propan-2-yloxy-benzoate

Systemtic Name: ethyl 3-nitro-4-propan-2-yloxy-benzoate Openeye Name: ethyl 4-isopropoxy-3-nitro-benzoate CAS Name: 3-nitro-4-propan-2-yloxybenzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-4-propan-2-yloxybenzoate Traditional Name: 4-isopropoxy-3-nitro-benzoic acid ethyl ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO5/c1-4-17-12(14)9-5-6-11(18-8(2)3)10(7-9)13(15)16/h5-8H,4H2,1-3H3