ethyl 2-ethyl-4-nitro-6-(propan-2-ylcarbamoylamino)benzoate

Systemtic Name: ethyl 2-ethyl-4-nitro-6-(propan-2-ylcarbamoylamino)benzoate Openeye Name: ethyl 2-ethyl-6-(isopropylcarbamoylamino)-4-nitro-benzoate CAS Name: 2-ethyl-4-nitro-6-[[oxo-(propan-2-ylamino)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-ethyl-4-nitro-6-(propan-2-ylcarbamoylamino)benzoate Traditional Name: 2-ethyl-6-(isopropylcarbamoylamino)-4-nitro-benzoic acid ethyl ester Formula: C15H21N3O5 MolecularWeight: 323.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1C(=O)OCC)NC(=O)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=CC(=C1C(=O)OCC)NC(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O5/c1-5-10-7-11(18(21)22)8-12(13(10)14(19)23-6-2)17-15(20)16-9(3)4/h7-9H,5-6H2,1-4H3,(H2,16,17,20)