methyl 5-(2-chloranyl-4-ethanoyl-phenoxy)-2-nitro-benzoate

Systemtic Name: methyl 5-(2-chloranyl-4-ethanoyl-phenoxy)-2-nitro-benzoate Openeye Name: methyl 5-(4-acetyl-2-chloro-phenoxy)-2-nitro-benzoate CAS Name: 5-(4-acetyl-2-chlorophenoxy)-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 5-(4-acetyl-2-chlorophenoxy)-2-nitrobenzoate Traditional Name: 5-(4-acetyl-2-chloro-phenoxy)-2-nitro-benzoic acid methyl ester Formula: C16H12ClNO6 MolecularWeight: 349.72258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)OC)Cl

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)OC)Cl

InChI

InChI=1S/C16H12ClNO6/c1-9(19)10-3-6-15(13(17)7-10)24-11-4-5-14(18(21)22)12(8-11)16(20)23-2/h3-8H,1-2H3