3,3-dimethyl-N-(1H-1,2,4-triazol-4-ium-4-yl)-4H-isoquinolin-1-amine

Systemtic Name: 3,3-dimethyl-N-(1H-1,2,4-triazol-4-ium-4-yl)-4H-isoquinolin-1-amine Openeye Name: 3,3-dimethyl-N-(1H-1,2,4-triazol-4-ium-4-yl)-4H-isoquinolin-1-amine CAS Name: 3,3-dimethyl-N-(1H-1,2,4-triazol-4-ium-4-yl)-4H-isoquinolin-1-amine IUPAC Name: 3,3-dimethyl-N-(1H-1,2,4-triazol-4-ium-4-yl)-4H-isoquinolin-1-amine Traditional Name: (3,3-dimethyl-4H-isoquinolin-1-yl)-(1H-1,2,4-triazol-4-ium-4-yl)amine Formula: C13H16N5+ MolecularWeight: 242.29964

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=N1)N[N+]3=CNN=C3)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=N1)N[N+]3=CNN=C3)C

InChI

InChI=1S/C13H15N5/c1-13(2)7-10-5-3-4-6-11(10)12(16-13)17-18-8-14-15-9-18/h3-6,8-9H,7H2,1-2H3,(H,16,17)/p+1