(3-chlorophenyl)methyl 2-methoxy-5-nitro-benzoate

Systemtic Name: (3-chlorophenyl)methyl 2-methoxy-5-nitro-benzoate Openeye Name: (3-chlorophenyl)methyl 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid (3-chlorobenzyl) ester Formula: C15H12ClNO5 MolecularWeight: 321.71248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC(=CC=C2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H12ClNO5/c1-21-14-6-5-12(17(19)20)8-13(14)15(18)22-9-10-3-2-4-11(16)7-10/h2-8H,9H2,1H3