2-(3-bromanylphenoxy)ethyl 4-ethoxy-5-methoxy-2-nitro-benzoate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 4-ethoxy-5-methoxy-2-nitro-benzoate Openeye Name: 2-(3-bromophenoxy)ethyl 4-ethoxy-5-methoxy-2-nitro-benzoate CAS Name: 4-ethoxy-5-methoxy-2-nitrobenzoic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 4-ethoxy-5-methoxy-2-nitrobenzoate Traditional Name: 4-ethoxy-5-methoxy-2-nitro-benzoic acid 2-(3-bromophenoxy)ethyl ester Formula: C18H18BrNO7 MolecularWeight: 440.24202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OCCOC2=CC(=CC=C2)Br)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OCCOC2=CC(=CC=C2)Br)OC

InChI

InChI=1S/C18H18BrNO7/c1-3-25-17-11-15(20(22)23)14(10-16(17)24-2)18(21)27-8-7-26-13-6-4-5-12(19)9-13/h4-6,9-11H,3,7-8H2,1-2H3