3,5-dimethoxy-2-nitro-4-phenylmethoxy-benzoic acid

Systemtic Name: 3,5-dimethoxy-2-nitro-4-phenylmethoxy-benzoic acid Openeye Name: 4-benzyloxy-3,5-dimethoxy-2-nitro-benzoic acid CAS Name: 3,5-dimethoxy-2-nitro-4-phenylmethoxybenzoic acid IUPAC Name: 3,5-dimethoxy-2-nitro-4-phenylmethoxybenzoic acid Traditional Name: 4-benzoxy-3,5-dimethoxy-2-nitro-benzoic acid Formula: C16H15NO7 MolecularWeight: 333.2928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO7/c1-22-12-8-11(16(18)19)13(17(20)21)15(23-2)14(12)24-9-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3,(H,18,19)