methyl 3-[2,5-bis(chloranyl)phenyl]-4-nitro-butanoate

Systemtic Name: methyl 3-[2,5-bis(chloranyl)phenyl]-4-nitro-butanoate Openeye Name: methyl 3-(2,5-dichlorophenyl)-4-nitro-butanoate CAS Name: 3-(2,5-dichlorophenyl)-4-nitrobutanoic acid methyl ester IUPAC Name: methyl 3-(2,5-dichlorophenyl)-4-nitrobutanoate Traditional Name: 3-(2,5-dichlorophenyl)-4-nitro-butyric acid methyl ester Formula: C11H11Cl2NO4 MolecularWeight: 292.11534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11Cl2NO4/c1-18-11(15)4-7(6-14(16)17)9-5-8(12)2-3-10(9)13/h2-3,5,7H,4,6H2,1H3