(4-acetamidophenyl) 2-(nitrooxymethyl)benzoate

Systemtic Name: (4-acetamidophenyl) 2-(nitrooxymethyl)benzoate Openeye Name: (4-acetamidophenyl) 2-(nitrooxymethyl)benzoate CAS Name: 2-(nitrooxymethyl)benzoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-(nitrooxymethyl)benzoate Traditional Name: 2-(nitrooxymethyl)benzoic acid (4-acetamidophenyl) ester Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2CO[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2CO[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O6/c1-11(19)17-13-6-8-14(9-7-13)24-16(20)15-5-3-2-4-12(15)10-23-18(21)22/h2-9H,10H2,1H3,(H,17,19)