2-[(4-bromanyl-3-nitro-phenyl)carbonylamino]butanoic acid

Systemtic Name: 2-[(4-bromanyl-3-nitro-phenyl)carbonylamino]butanoic acid Openeye Name: 2-[(4-bromo-3-nitro-benzoyl)amino]butanoic acid CAS Name: 2-[[(4-bromo-3-nitrophenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(4-bromo-3-nitrobenzoyl)amino]butanoic acid Traditional Name: 2-[(4-bromo-3-nitro-benzoyl)amino]butyric acid Formula: C11H11BrN2O5 MolecularWeight: 331.11944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11BrN2O5/c1-2-8(11(16)17)13-10(15)6-3-4-7(12)9(5-6)14(18)19/h3-5,8H,2H2,1H3,(H,13,15)(H,16,17)