(3S)-5-oxidanylidene-1-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate

Systemtic Name: (3S)-5-oxidanylidene-1-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate Openeye Name: (3S)-1-benzyl-5-oxo-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate CAS Name: (3S)-5-oxo-1-(phenylmethyl)-N-(1H-1,2,4-triazol-5-yl)-3-pyrrolidinecarboximidate IUPAC Name: (3S)-1-benzyl-5-oxo-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate Traditional Name: (3S)-1-benzyl-5-keto-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboximidate Formula: C14H14N5O2- MolecularWeight: 284.29326

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CC=C2)C(=NC3=NC=NN3)[O-]

Isomeric SMILES

C1[C@@H](CN(C1=O)CC2=CC=CC=C2)C(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C14H15N5O2/c20-12-6-11(13(21)17-14-15-9-16-18-14)8-19(12)7-10-4-2-1-3-5-10/h1-5,9,11H,6-8H2,(H2,15,16,17,18,21)/p-1/t11-/m0/s1