[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-azanyl-5-nitro-benzoate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-azanyl-5-nitro-benzoate Openeye Name: [2-(dimethylamino)-2-oxo-1-phenyl-ethyl] 2-amino-5-nitro-benzoate CAS Name: 2-amino-5-nitrobenzoic acid [2-(dimethylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxo-1-phenylethyl] 2-amino-5-nitrobenzoate Traditional Name: 2-amino-5-nitro-benzoic acid [2-(dimethylamino)-2-keto-1-phenyl-ethyl] ester Formula: C17H17N3O5 MolecularWeight: 343.33398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O5/c1-19(2)16(21)15(11-6-4-3-5-7-11)25-17(22)13-10-12(20(23)24)8-9-14(13)18/h3-10,15H,18H2,1-2H3