ethyl 3-(2-methylbutan-2-ylcarbamoyl)-5-nitro-benzoate

Systemtic Name: ethyl 3-(2-methylbutan-2-ylcarbamoyl)-5-nitro-benzoate Openeye Name: ethyl 3-(1,1-dimethylpropylcarbamoyl)-5-nitro-benzoate CAS Name: 3-[(2-methylbutan-2-ylamino)-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-(2-methylbutan-2-ylcarbamoyl)-5-nitrobenzoate Traditional Name: 3-(tert-amylcarbamoyl)-5-nitro-benzoic acid ethyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O5/c1-5-15(3,4)16-13(18)10-7-11(14(19)22-6-2)9-12(8-10)17(20)21/h7-9H,5-6H2,1-4H3,(H,16,18)