5-methoxy-2-nitro-4-phenylmethoxy-benzoate

Systemtic Name: 5-methoxy-2-nitro-4-phenylmethoxy-benzoate Openeye Name: 4-benzyloxy-5-methoxy-2-nitro-benzoate CAS Name: 5-methoxy-2-nitro-4-phenylmethoxybenzoate IUPAC Name: 5-methoxy-2-nitro-4-phenylmethoxybenzoate Traditional Name: 4-benzoxy-5-methoxy-2-nitro-benzoate Formula: C15H12NO6- MolecularWeight: 302.25888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO6/c1-21-13-7-11(15(17)18)12(16(19)20)8-14(13)22-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H,17,18)/p-1