methyl 3-[3,5-bis(bromanyl)phenyl]-4-nitro-butanoate

Systemtic Name: methyl 3-[3,5-bis(bromanyl)phenyl]-4-nitro-butanoate Openeye Name: methyl 3-(3,5-dibromophenyl)-4-nitro-butanoate CAS Name: 3-(3,5-dibromophenyl)-4-nitrobutanoic acid methyl ester IUPAC Name: methyl 3-(3,5-dibromophenyl)-4-nitrobutanoate Traditional Name: 3-(3,5-dibromophenyl)-4-nitro-butyric acid methyl ester Formula: C11H11Br2NO4 MolecularWeight: 381.01734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11Br2NO4/c1-18-11(15)4-8(6-14(16)17)7-2-9(12)5-10(13)3-7/h2-3,5,8H,4,6H2,1H3