[4-(methylcarbamoyl)phenyl] 4-(dimethylamino)-3-nitro-benzoate

Systemtic Name: [4-(methylcarbamoyl)phenyl] 4-(dimethylamino)-3-nitro-benzoate Openeye Name: [4-(methylcarbamoyl)phenyl] 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid [4-(methylcarbamoyl)phenyl] ester IUPAC Name: [4-(methylcarbamoyl)phenyl] 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid [4-(methylcarbamoyl)phenyl] ester Formula: C17H17N3O5 MolecularWeight: 343.33398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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