ethyl 2-azanyl-3,6-diethyl-4-nitro-benzoate

Systemtic Name: ethyl 2-azanyl-3,6-diethyl-4-nitro-benzoate Openeye Name: ethyl 2-amino-3,6-diethyl-4-nitro-benzoate CAS Name: 2-amino-3,6-diethyl-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-amino-3,6-diethyl-4-nitrobenzoate Traditional Name: 2-amino-3,6-diethyl-4-nitro-benzoic acid ethyl ester Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4/c1-4-8-7-10(15(17)18)9(5-2)12(14)11(8)13(16)19-6-3/h7H,4-6,14H2,1-3H3