ethyl 2-azanyl-4-nitro-6-propyl-benzoate

Systemtic Name: ethyl 2-azanyl-4-nitro-6-propyl-benzoate Openeye Name: ethyl 2-amino-4-nitro-6-propyl-benzoate CAS Name: 2-amino-4-nitro-6-propylbenzoic acid ethyl ester IUPAC Name: ethyl 2-amino-4-nitro-6-propylbenzoate Traditional Name: 2-amino-4-nitro-6-propyl-benzoic acid ethyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1C(=O)OCC)N)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=CC(=C1C(=O)OCC)N)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4/c1-3-5-8-6-9(14(16)17)7-10(13)11(8)12(15)18-4-2/h6-7H,3-5,13H2,1-2H3