(phenylmethyl) 4-nitrobenzoate

Systemtic Name: (phenylmethyl) 4-nitrobenzoate Openeye Name: benzyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid benzyl ester Formula: C14H11NO4 MolecularWeight: 257.24144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO4/c16-14(19-10-11-4-2-1-3-5-11)12-6-8-13(9-7-12)15(17)18/h1-9H,10H2