7-[(4-bromanyl-2-nitro-phenyl)amino]heptanoate

Systemtic Name: 7-[(4-bromanyl-2-nitro-phenyl)amino]heptanoate Openeye Name: 7-(4-bromo-2-nitro-anilino)heptanoate CAS Name: 7-(4-bromo-2-nitroanilino)heptanoate IUPAC Name: 7-(4-bromo-2-nitroanilino)heptanoate Traditional Name: 7-(4-bromo-2-nitro-anilino)enanthate Formula: C13H16BrN2O4- MolecularWeight: 344.18114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)[N+](=O)[O-])NCCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Br)[N+](=O)[O-])NCCCCCCC(=O)[O-]

InChI

InChI=1S/C13H17BrN2O4/c14-10-6-7-11(12(9-10)16(19)20)15-8-4-2-1-3-5-13(17)18/h6-7,9,15H,1-5,8H2,(H,17,18)/p-1