5-nitro-2-pyrrolidin-1-yl-benzoic acid

Systemtic Name: 5-nitro-2-pyrrolidin-1-yl-benzoic acid Openeye Name: 5-nitro-2-pyrrolidin-1-yl-benzoic acid CAS Name: 5-nitro-2-(1-pyrrolidinyl)benzoic acid IUPAC Name: 5-nitro-2-pyrrolidin-1-ylbenzoic acid Traditional Name: 5-nitro-2-pyrrolidino-benzoic acid Formula: C11H12N2O4 MolecularWeight: 236.22398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H12N2O4/c14-11(15)9-7-8(13(16)17)3-4-10(9)12-5-1-2-6-12/h3-4,7H,1-2,5-6H2,(H,14,15)