propyl 4-bromanyl-3-ethyl-5-nitro-benzoate

Systemtic Name: propyl 4-bromanyl-3-ethyl-5-nitro-benzoate Openeye Name: propyl 4-bromo-3-ethyl-5-nitro-benzoate CAS Name: 4-bromo-3-ethyl-5-nitrobenzoic acid propyl ester IUPAC Name: propyl 4-bromo-3-ethyl-5-nitrobenzoate Traditional Name: 4-bromo-3-ethyl-5-nitro-benzoic acid propyl ester Formula: C12H14BrNO4 MolecularWeight: 316.14786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO4/c1-3-5-18-12(15)9-6-8(4-2)11(13)10(7-9)14(16)17/h6-7H,3-5H2,1-2H3