2-methylpropyl 3-azanyl-2,4-bis(bromanyl)-6-nitro-benzoate

Systemtic Name: 2-methylpropyl 3-azanyl-2,4-bis(bromanyl)-6-nitro-benzoate Openeye Name: isobutyl 3-amino-2,4-dibromo-6-nitro-benzoate CAS Name: 3-amino-2,4-dibromo-6-nitrobenzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-amino-2,4-dibromo-6-nitrobenzoate Traditional Name: 3-amino-2,4-dibromo-6-nitro-benzoic acid isobutyl ester Formula: C11H12Br2N2O4 MolecularWeight: 396.03198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=C(C(=C(C=C1[N+](=O)[O-])Br)N)Br

Isomeric SMILES

CC(C)COC(=O)C1=C(C(=C(C=C1[N+](=O)[O-])Br)N)Br

InChI

InChI=1S/C11H12Br2N2O4/c1-5(2)4-19-11(16)8-7(15(17)18)3-6(12)10(14)9(8)13/h3,5H,4,14H2,1-2H3