(phenylmethyl) 5-methoxy-2-nitro-4-phenylmethoxy-benzoate

Systemtic Name: (phenylmethyl) 5-methoxy-2-nitro-4-phenylmethoxy-benzoate Openeye Name: benzyl 4-benzyloxy-5-methoxy-2-nitro-benzoate CAS Name: 5-methoxy-2-nitro-4-phenylmethoxybenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methoxy-2-nitro-4-phenylmethoxybenzoate Traditional Name: 4-benzoxy-5-methoxy-2-nitro-benzoic acid benzyl ester Formula: C22H19NO6 MolecularWeight: 393.38936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC2=CC=CC=C2)[N+](=O)[O-])OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC2=CC=CC=C2)[N+](=O)[O-])OCC3=CC=CC=C3

InChI

InChI=1S/C22H19NO6/c1-27-20-12-18(22(24)29-15-17-10-6-3-7-11-17)19(23(25)26)13-21(20)28-14-16-8-4-2-5-9-16/h2-13H,14-15H2,1H3