2-(3-bromanylphenoxy)ethyl 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 4,5-dimethoxy-2-nitro-benzoate Openeye Name: 2-(3-bromophenoxy)ethyl 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid 2-(3-bromophenoxy)ethyl ester Formula: C17H16BrNO7 MolecularWeight: 426.21544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCCOC2=CC(=CC=C2)Br)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCCOC2=CC(=CC=C2)Br)[N+](=O)[O-])OC

InChI

InChI=1S/C17H16BrNO7/c1-23-15-9-13(14(19(21)22)10-16(15)24-2)17(20)26-7-6-25-12-5-3-4-11(18)8-12/h3-5,8-10H,6-7H2,1-2H3