carboxy-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]carbamic acid

Systemtic Name: carboxy-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]carbamic acid Openeye Name: carboxy-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]carbamic acid CAS Name: carboxy-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]carbamic acid IUPAC Name: carboxy-[[3-nitro-5-(trifluoromethyl)phenyl]methyl]carbamic acid Traditional Name: carboxy-[3-nitro-5-(trifluoromethyl)benzyl]carbamic acid Formula: C10H7F3N2O6 MolecularWeight: 308.16759

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7F3N2O6/c11-10(12,13)6-1-5(2-7(3-6)15(20)21)4-14(8(16)17)9(18)19/h1-3H,4H2,(H,16,17)(H,18,19)