5-(2-aminocarbonylpyrrolidin-1-yl)-2-nitro-benzoic acid

Systemtic Name: 5-(2-aminocarbonylpyrrolidin-1-yl)-2-nitro-benzoic acid Openeye Name: 5-(2-carbamoylpyrrolidin-1-yl)-2-nitro-benzoic acid CAS Name: 5-(2-carbamoyl-1-pyrrolidinyl)-2-nitrobenzoic acid IUPAC Name: 5-(2-carbamoylpyrrolidin-1-yl)-2-nitrobenzoic acid Traditional Name: 5-(2-carbamoylpyrrolidino)-2-nitro-benzoic acid Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)N

Isomeric SMILES

C1CC(N(C1)C2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)N

InChI

InChI=1S/C12H13N3O5/c13-11(16)10-2-1-5-14(10)7-3-4-9(15(19)20)8(6-7)12(17)18/h3-4,6,10H,1-2,5H2,(H2,13,16)(H,17,18)