ethyl 3-nitro-5-[[2-(propylcarbamoyl)phenyl]carbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[[2-(propylcarbamoyl)phenyl]carbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[[2-(propylcarbamoyl)phenyl]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[2-[oxo(propylamino)methyl]anilino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[[2-(propylcarbamoyl)phenyl]carbamoyl]benzoate Traditional Name: 3-nitro-5-[[2-(propylcarbamoyl)phenyl]carbamoyl]benzoic acid ethyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C20H21N3O6/c1-3-9-21-19(25)16-7-5-6-8-17(16)22-18(24)13-10-14(20(26)29-4-2)12-15(11-13)23(27)28/h5-8,10-12H,3-4,9H2,1-2H3,(H,21,25)(H,22,24)