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

Systemtic Name: methyl 2-(4-chloranyl-2-methyl-phenoxy)-5-nitro-benzoate Openeye Name: methyl 2-(4-chloro-2-methyl-phenoxy)-5-nitro-benzoate CAS Name: 2-(4-chloro-2-methylphenoxy)-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(4-chloro-2-methylphenoxy)-5-nitrobenzoate Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-5-nitro-benzoic acid methyl ester Formula: C15H12ClNO5 MolecularWeight: 321.71248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H12ClNO5/c1-9-7-10(16)3-5-13(9)22-14-6-4-11(17(19)20)8-12(14)15(18)21-2/h3-8H,1-2H3