(phenylmethyl) 3-nitro-4-oxidanyl-benzoate

Systemtic Name: (phenylmethyl) 3-nitro-4-oxidanyl-benzoate Openeye Name: benzyl 4-hydroxy-3-nitro-benzoate CAS Name: 4-hydroxy-3-nitrobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-hydroxy-3-nitrobenzoate Traditional Name: 4-hydroxy-3-nitro-benzoic acid benzyl ester Formula: C14H11NO5 MolecularWeight: 273.24084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO5/c16-13-7-6-11(8-12(13)15(18)19)14(17)20-9-10-4-2-1-3-5-10/h1-8,16H,9H2