5-nitro-2-(oxolan-2-ylmethylamino)benzoic acid

Systemtic Name: 5-nitro-2-(oxolan-2-ylmethylamino)benzoic acid Openeye Name: 5-nitro-2-(tetrahydrofuran-2-ylmethylamino)benzoic acid CAS Name: 5-nitro-2-(2-oxolanylmethylamino)benzoic acid IUPAC Name: 5-nitro-2-(oxolan-2-ylmethylamino)benzoic acid Traditional Name: 5-nitro-2-(tetrahydrofurfurylamino)benzoic acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CC(OC1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H14N2O5/c15-12(16)10-6-8(14(17)18)3-4-11(10)13-7-9-2-1-5-19-9/h3-4,6,9,13H,1-2,5,7H2,(H,15,16)