[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 4-methyl-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 4-methyl-3-nitro-benzoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C14H17N3O6 MolecularWeight: 323.30128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O6/c1-3-6-15-14(20)16-12(18)8-23-13(19)10-5-4-9(2)11(7-10)17(21)22/h4-5,7H,3,6,8H2,1-2H3,(H2,15,16,18,20)