ethyl 2-azanyl-6-(2-methylpropyl)-4-nitro-benzoate

Systemtic Name: ethyl 2-azanyl-6-(2-methylpropyl)-4-nitro-benzoate Openeye Name: ethyl 2-amino-6-isobutyl-4-nitro-benzoate CAS Name: 2-amino-6-(2-methylpropyl)-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-amino-6-(2-methylpropyl)-4-nitrobenzoate Traditional Name: 2-amino-6-isobutyl-4-nitro-benzoic acid ethyl ester Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1CC(C)C)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1CC(C)C)[N+](=O)[O-])N

InChI

InChI=1S/C13H18N2O4/c1-4-19-13(16)12-9(5-8(2)3)6-10(15(17)18)7-11(12)14/h6-8H,4-5,14H2,1-3H3