(2-chloranyl-4-nitro-phenyl) 4-bromanyl-3,5-dimethoxy-benzoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 4-bromanyl-3,5-dimethoxy-benzoate Openeye Name: (2-chloro-4-nitro-phenyl) 4-bromo-3,5-dimethoxy-benzoate CAS Name: 4-bromo-3,5-dimethoxybenzoic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 4-bromo-3,5-dimethoxybenzoate Traditional Name: 4-bromo-3,5-dimethoxy-benzoic acid (2-chloro-4-nitro-phenyl) ester Formula: C15H11BrClNO6 MolecularWeight: 416.60794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H11BrClNO6/c1-22-12-5-8(6-13(23-2)14(12)16)15(19)24-11-4-3-9(18(20)21)7-10(11)17/h3-7H,1-2H3