methyl 2-[4-(3-bromanylpropoxy)-3-nitro-phenyl]ethanoate

Systemtic Name: methyl 2-[4-(3-bromanylpropoxy)-3-nitro-phenyl]ethanoate Openeye Name: methyl 2-[4-(3-bromopropoxy)-3-nitro-phenyl]acetate CAS Name: 2-[4-(3-bromopropoxy)-3-nitrophenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3-bromopropoxy)-3-nitrophenyl]acetate Traditional Name: 2-[4-(3-bromopropoxy)-3-nitro-phenyl]acetic acid methyl ester Formula: C12H14BrNO5 MolecularWeight: 332.14726

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=C(C=C1)OCCCBr)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC1=CC(=C(C=C1)OCCCBr)[N+](=O)[O-]

InChI

InChI=1S/C12H14BrNO5/c1-18-12(15)8-9-3-4-11(19-6-2-5-13)10(7-9)14(16)17/h3-4,7H,2,5-6,8H2,1H3