N-[5-[[(4S)-2-oxidanylidene-4-phenyl-pyrrolidin-1-yl]methyl]-1H-1,2,4-triazol-3-yl]nitramide

Systemtic Name: N-[5-[[(4S)-2-oxidanylidene-4-phenyl-pyrrolidin-1-yl]methyl]-1H-1,2,4-triazol-3-yl]nitramide Openeye Name: N-[5-[[(4S)-2-oxo-4-phenyl-pyrrolidin-1-yl]methyl]-1H-1,2,4-triazol-3-yl]nitramide CAS Name: N-[5-[[(4S)-2-oxo-4-phenyl-1-pyrrolidinyl]methyl]-1H-1,2,4-triazol-3-yl]nitramide IUPAC Name: N-[5-[[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]methyl]-1H-1,2,4-triazol-3-yl]nitramide Traditional Name: N-[5-[[(4S)-2-keto-4-phenyl-pyrrolidino]methyl]-1H-1,2,4-triazol-3-yl]nitramide Formula: C13H14N6O3 MolecularWeight: 302.28866

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=NC(=NN2)N[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1[C@H](CN(C1=O)CC2=NC(=NN2)N[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C13H14N6O3/c20-12-6-10(9-4-2-1-3-5-9)7-18(12)8-11-14-13(16-15-11)17-19(21)22/h1-5,10H,6-8H2,(H2,14,15,16,17)/t10-/m1/s1