ethyl 3-nitro-5-(pentylcarbamoyl)benzoate

Systemtic Name: ethyl 3-nitro-5-(pentylcarbamoyl)benzoate Openeye Name: ethyl 3-nitro-5-(pentylcarbamoyl)benzoate CAS Name: 3-nitro-5-[oxo-(pentylamino)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-(pentylcarbamoyl)benzoate Traditional Name: 3-(amylcarbamoyl)-5-nitro-benzoic acid ethyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCCCCNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C15H20N2O5/c1-3-5-6-7-16-14(18)11-8-12(15(19)22-4-2)10-13(9-11)17(20)21/h8-10H,3-7H2,1-2H3,(H,16,18)