ethyl 2-azanyl-3-methyl-4-nitro-6-propan-2-yl-benzoate

Systemtic Name: ethyl 2-azanyl-3-methyl-4-nitro-6-propan-2-yl-benzoate Openeye Name: ethyl 2-amino-6-isopropyl-3-methyl-4-nitro-benzoate CAS Name: 2-amino-3-methyl-4-nitro-6-propan-2-ylbenzoic acid ethyl ester IUPAC Name: ethyl 2-amino-3-methyl-4-nitro-6-propan-2-ylbenzoate Traditional Name: 2-amino-6-isopropyl-3-methyl-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=C1C(C)C)[N+](=O)[O-])C)N

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1C(C)C)[N+](=O)[O-])C)N

InChI

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