ethyl 3-nitro-2-(propan-2-ylamino)benzoate

Systemtic Name: ethyl 3-nitro-2-(propan-2-ylamino)benzoate Openeye Name: ethyl 2-(isopropylamino)-3-nitro-benzoate CAS Name: 3-nitro-2-(propan-2-ylamino)benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-2-(propan-2-ylamino)benzoate Traditional Name: 2-(isopropylamino)-3-nitro-benzoic acid ethyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4/c1-4-18-12(15)9-6-5-7-10(14(16)17)11(9)13-8(2)3/h5-8,13H,4H2,1-3H3