methyl 3-(3-bromanyl-4-methoxy-5-nitro-phenyl)propanoate

Systemtic Name: methyl 3-(3-bromanyl-4-methoxy-5-nitro-phenyl)propanoate Openeye Name: methyl 3-(3-bromo-4-methoxy-5-nitro-phenyl)propanoate CAS Name: 3-(3-bromo-4-methoxy-5-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(3-bromo-4-methoxy-5-nitrophenyl)propanoate Traditional Name: 3-(3-bromo-4-methoxy-5-nitro-phenyl)propionic acid methyl ester Formula: C11H12BrNO5 MolecularWeight: 318.12068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)CCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1Br)CCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H12BrNO5/c1-17-10(14)4-3-7-5-8(12)11(18-2)9(6-7)13(15)16/h5-6H,3-4H2,1-2H3