(5S)-5-phenyl-3-pyrrolidin-1-ium-1-ylidene-4,5-dihydro-2H-1,2,4-triazine

Systemtic Name: (5S)-5-phenyl-3-pyrrolidin-1-ium-1-ylidene-4,5-dihydro-2H-1,2,4-triazine Openeye Name: (5S)-5-phenyl-3-pyrrolidin-1-ium-1-ylidene-4,5-dihydro-2H-1,2,4-triazine CAS Name: (5S)-5-phenyl-3-(1-pyrrolidin-1-iumylidene)-4,5-dihydro-2H-1,2,4-triazine IUPAC Name: (5S)-5-phenyl-3-pyrrolidin-1-ium-1-ylidene-4,5-dihydro-2H-1,2,4-triazine Traditional Name: (5S)-5-phenyl-3-pyrrolidin-1-ium-1-ylidene-4,5-dihydro-2H-1,2,4-triazine Formula: C13H17N4+ MolecularWeight: 229.30088

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C2NC(C=NN2)C3=CC=CC=C3)C1

Isomeric SMILES

C1CC[N+](=C2N[C@H](C=NN2)C3=CC=CC=C3)C1

InChI

InChI=1S/C13H16N4/c1-2-6-11(7-3-1)12-10-14-16-13(15-12)17-8-4-5-9-17/h1-3,6-7,10,12H,4-5,8-9H2,(H,15,16)/p+1/t12-/m1/s1