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

Systemtic Name: 2-[(4-bromanyl-3-nitro-phenyl)carbonylamino]-2-cyclopropyl-propanoic acid Openeye Name: 2-[(4-bromo-3-nitro-benzoyl)amino]-2-cyclopropyl-propanoic acid CAS Name: 2-[[(4-bromo-3-nitrophenyl)-oxomethyl]amino]-2-cyclopropylpropanoic acid IUPAC Name: 2-[(4-bromo-3-nitrobenzoyl)amino]-2-cyclopropylpropanoic acid Traditional Name: 2-[(4-bromo-3-nitro-benzoyl)amino]-2-cyclopropyl-propionic acid Formula: C13H13BrN2O5 MolecularWeight: 357.15672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)(C(=O)O)NC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C1CC1)(C(=O)O)NC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H13BrN2O5/c1-13(12(18)19,8-3-4-8)15-11(17)7-2-5-9(14)10(6-7)16(20)21/h2,5-6,8H,3-4H2,1H3,(H,15,17)(H,18,19)