(4-acetamidophenyl) 2-(dimethylamino)-5-nitro-benzoate

Systemtic Name: (4-acetamidophenyl) 2-(dimethylamino)-5-nitro-benzoate Openeye Name: (4-acetamidophenyl) 2-(dimethylamino)-5-nitro-benzoate CAS Name: 2-(dimethylamino)-5-nitrobenzoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-(dimethylamino)-5-nitrobenzoate Traditional Name: 2-(dimethylamino)-5-nitro-benzoic acid (4-acetamidophenyl) ester Formula: C17H17N3O5 MolecularWeight: 343.33398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O5/c1-11(21)18-12-4-7-14(8-5-12)25-17(22)15-10-13(20(23)24)6-9-16(15)19(2)3/h4-10H,1-3H3,(H,18,21)