3-nitro-4-pyrrolidin-1-yl-benzoic acid

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-benzoic acid Openeye Name: 3-nitro-4-pyrrolidin-1-yl-benzoic acid CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzoic acid IUPAC Name: 3-nitro-4-pyrrolidin-1-ylbenzoic acid Traditional Name: 3-nitro-4-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)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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