sodium 3-ethoxy-5-nitro-4-phenyl-benzoate

Systemtic Name: sodium 3-ethoxy-5-nitro-4-phenyl-benzoate Openeye Name: sodium 3-ethoxy-5-nitro-4-phenyl-benzoate CAS Name: sodium 3-ethoxy-5-nitro-4-phenylbenzoate IUPAC Name: sodium 3-ethoxy-5-nitro-4-phenylbenzoate Traditional Name: sodium 3-ethoxy-5-nitro-4-phenyl-benzoate Formula: C15H12NNaO5 MolecularWeight: 309.24925

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C2=CC=CC=C2)[N+](=O)[O-])C(=O)[O-].[Na+]

Isomeric SMILES

CCOC1=CC(=CC(=C1C2=CC=CC=C2)[N+](=O)[O-])C(=O)[O-].[Na+]

InChI

InChI=1S/C15H13NO5.Na/c1-2-21-13-9-11(15(17)18)8-12(16(19)20)14(13)10-6-4-3-5-7-10;/h3-9H,2H2,1H3,(H,17,18);/q;+1/p-1