ethyl 2-azanyl-3-methyl-4-nitro-6-propyl-benzoate

Systemtic Name: ethyl 2-azanyl-3-methyl-4-nitro-6-propyl-benzoate Openeye Name: ethyl 2-amino-3-methyl-4-nitro-6-propyl-benzoate CAS Name: 2-amino-3-methyl-4-nitro-6-propylbenzoic acid ethyl ester IUPAC Name: ethyl 2-amino-3-methyl-4-nitro-6-propylbenzoate Traditional Name: 2-amino-3-methyl-4-nitro-6-propyl-benzoic acid ethyl ester Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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