[2-oxidanylidene-2-(propan-2-ylamino)ethyl] 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: [2-(isopropylamino)-2-oxo-ethyl] 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylamino)ethyl] 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid [2-(isopropylamino)-2-keto-ethyl] ester Formula: C15H21N3O6 MolecularWeight: 339.34374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O6/c1-10(2)17-14(19)9-24-15(20)12-8-11(18(21)22)4-5-13(12)16-6-7-23-3/h4-5,8,10,16H,6-7,9H2,1-3H3,(H,17,19)