3-nitro-4-pyrrolidin-1-yl-N-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-N-(1,2,4-triazol-4-yl)benzamide Openeye Name: 3-nitro-4-pyrrolidin-1-yl-N-(1,2,4-triazol-4-yl)benzamide CAS Name: 3-nitro-4-(1-pyrrolidinyl)-N-(1,2,4-triazol-4-yl)benzamide IUPAC Name: 3-nitro-4-pyrrolidin-1-yl-N-(1,2,4-triazol-4-yl)benzamide Traditional Name: 3-nitro-4-pyrrolidino-N-(1,2,4-triazol-4-yl)benzamide Formula: C13H14N6O3 MolecularWeight: 302.28866

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NN3C=NN=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NN3C=NN=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O3/c20-13(16-18-8-14-15-9-18)10-3-4-11(12(7-10)19(21)22)17-5-1-2-6-17/h3-4,7-9H,1-2,5-6H2,(H,16,20)