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

Systemtic Name: 3-nitro-4-piperazin-1-yl-benzoic acid Openeye Name: 3-nitro-4-piperazin-1-yl-benzoic acid CAS Name: 3-nitro-4-(1-piperazinyl)benzoic acid IUPAC Name: 3-nitro-4-piperazin-1-ylbenzoic acid Traditional Name: 3-nitro-4-piperazino-benzoic acid Formula: C11H13N3O4 MolecularWeight: 251.23862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O4/c15-11(16)8-1-2-9(10(7-8)14(17)18)13-5-3-12-4-6-13/h1-2,7,12H,3-6H2,(H,15,16)